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Compile Data Set for Download or QSAR

Found 78 hits of ic50 for UniProtKB: P07265   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50016703
PNG
(2-Hydroxymethyl-pyrrolidine-3,4-diol | BDBM5003148...)
Show SMILES OC[C@H]1NC[C@@H](O)[C@@H]1O
Show InChI InChI=1/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5-/s2
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n/an/a 840n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of yeast maltase alpha-glucosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50031481
PNG
((2R,3R,4R,5R)-2,5-Bis-hydroxymethyl-pyrrolidine-3,...)
Show SMILES OC[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O
Show InChI InChI=1/C6H13NO4/c8-1-3-5(10)6(11)4(2-9)7-3/h3-11H,1-2H2/t3-,4-,5-,6-/s2
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n/an/a 2.00E+3n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of yeast maltase alpha-glucosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486726
PNG
(TRAMETENOLIC ACID | Trametenolic Acid)
Show SMILES CC(C)=CCC[C@H]([C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3)C(O)=O
Show InChI InChI=1S/C30H48O3/c1-19(2)9-8-10-20(26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h9,20-21,24-25,31H,8,10-18H2,1-7H3,(H,32,33)/t20-,21-,24+,25+,28-,29-,30+/m1/s1
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n/an/a 1.71E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Saccharomyces cerevisiae (baker's yeast) alpha-glucosidase using p-nitrophenyl glucopyranoside as substrate preincubated for 30 min bef...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341135
PNG
(CHEMBL1760547 | N-p-Coumaroyl serotonin)
Show SMILES Oc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)cc1
Show InChI InChI=1S/C19H18N2O3/c22-15-4-1-13(2-5-15)3-8-19(24)20-10-9-14-12-21-18-7-6-16(23)11-17(14)18/h1-8,11-12,21-23H,9-10H2,(H,20,24)/b8-3+
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n/an/a 4.72E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50296247
PNG
(3-(3,4-Dihydroxyphenyl)-N-[2-(5-hydroxyindol-3-yl)...)
Show SMILES Oc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccc(O)c(O)c3)c2c1
Show InChI InChI=1S/C19H18N2O4/c22-14-3-4-16-15(10-14)13(11-21-16)7-8-20-19(25)6-2-12-1-5-17(23)18(24)9-12/h1-6,9-11,21-24H,7-8H2,(H,20,25)/b6-2+
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n/an/a 4.82E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341139
PNG
(CHEMBL1760551 | N-Sinapoyl serotonin)
Show SMILES COc1cc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)cc(OC)c1O
Show InChI InChI=1S/C21H22N2O5/c1-27-18-9-13(10-19(28-2)21(18)26)3-6-20(25)22-8-7-14-12-23-17-5-4-15(24)11-16(14)17/h3-6,9-12,23-24,26H,7-8H2,1-2H3,(H,22,25)/b6-3+
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n/an/a 6.62E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50234562
PNG
(1,4-Dideoxy-1,4-imino-(hydroxyethyliminiumyl)-D-ar...)
Show SMILES OCCN1C[C@@H](O)[C@H](O)[C@H]1CO
Show InChI InChI=1/C7H15NO4/c9-2-1-8-3-6(11)7(12)5(8)4-10/h5-7,9-12H,1-4H2/t5-,6-,7-/s2
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n/an/a 7.80E+4n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of yeast maltase alpha-glucosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341134
PNG
(CHEMBL1760546 | N-Cinnamoyl serotonin)
Show SMILES Oc1ccc2[nH]cc(CCNC(=O)\C=C\c3ccccc3)c2c1
Show InChI InChI=1S/C19H18N2O2/c22-16-7-8-18-17(12-16)15(13-21-18)10-11-20-19(23)9-6-14-4-2-1-3-5-14/h1-9,12-13,21-22H,10-11H2,(H,20,23)/b9-6+
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n/an/a 8.08E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50296246
PNG
(CHEMBL564482 | N-Feruloylserotonin)
Show SMILES COc1cc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)ccc1O
Show InChI InChI=1S/C20H20N2O4/c1-26-19-10-13(2-6-18(19)24)3-7-20(25)21-9-8-14-12-22-17-5-4-15(23)11-16(14)17/h2-7,10-12,22-24H,8-9H2,1H3,(H,21,25)/b7-3+
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n/an/a 9.98E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM18351
PNG
((2R,3R,4R,5S)-2-(Hydroxymethyl)piperidine-3,4,5-tr...)
Show SMILES OC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
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n/an/a 1.10E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of yeast maltase alpha-glucosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341142
PNG
((E)-3-(4-Hydroxy-3,5-dimethoxy-phenyl)-acrylic aci...)
Show SMILES COc1cc(\C=C\C(O)=O)cc(OC)c1O
Show InChI InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+
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n/an/a 1.45E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50242270
PNG
((2R,3R,4R,5R)-1-ethoxy-2,5-bis(hydroxymethyl)pyrro...)
Show SMILES OCCN1[C@H](CO)[C@@H](O)[C@H](O)[C@H]1CO
Show InChI InChI=1/C8H17NO5/c10-2-1-9-5(3-11)7(13)8(14)6(9)4-12/h5-8,10-14H,1-4H2/t5-,6-,7-,8-/s2
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n/an/a 2.60E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of yeast maltase alpha-glucosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM18351
PNG
((2R,3R,4R,5S)-2-(Hydroxymethyl)piperidine-3,4,5-tr...)
Show SMILES OC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
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n/an/a 2.78E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50214744
PNG
((2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic aci...)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1O
Show InChI InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341137
PNG
(CHEMBL1760549 | N-Isoferuloyl serotonin)
Show SMILES COc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)cc1O
Show InChI InChI=1S/C20H20N2O4/c1-26-19-6-2-13(10-18(19)24)3-7-20(25)21-9-8-14-12-22-17-5-4-15(23)11-16(14)17/h2-7,10-12,22-24H,8-9H2,1H3,(H,21,25)/b7-3+
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486694
PNG
(N-DIHYDROSINAPOYL SEROTONIN)
Show SMILES COc1cc(CCC(=O)NCCc2c[nH]c3ccc(O)cc23)cc(OC)c1O
Show InChI InChI=1S/C21H24N2O5/c1-27-18-9-13(10-19(28-2)21(18)26)3-6-20(25)22-8-7-14-12-23-17-5-4-15(24)11-16(14)17/h4-5,9-12,23-24,26H,3,6-8H2,1-2H3,(H,22,25)
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486693
PNG
(N-DIHYDROCAFFEOYL SEROTONIN)
Show SMILES Oc1ccc2[nH]cc(CCNC(=O)CCc3ccc(O)c(O)c3)c2c1
Show InChI InChI=1S/C19H20N2O4/c22-14-3-4-16-15(10-14)13(11-21-16)7-8-20-19(25)6-2-12-1-5-17(23)18(24)9-12/h1,3-5,9-11,21-24H,2,6-8H2,(H,20,25)
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341138
PNG
(CHEMBL1760550 | N-3,4-Dimethoxy cinnamoyl serotoni...)
Show SMILES COc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)cc1OC
Show InChI InChI=1S/C21H22N2O4/c1-26-19-7-3-14(11-20(19)27-2)4-8-21(25)22-10-9-15-13-23-18-6-5-16(24)12-17(15)18/h3-8,11-13,23-24H,9-10H2,1-2H3,(H,22,25)/b8-4+
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486692
PNG
(N-DIHYDROFERULOYL SEROTONIN)
Show SMILES COc1cc(CCC(=O)NCCc2c[nH]c3ccc(O)cc23)ccc1O
Show InChI InChI=1S/C20H22N2O4/c1-26-19-10-13(2-6-18(19)24)3-7-20(25)21-9-8-14-12-22-17-5-4-15(23)11-16(14)17/h2,4-6,10-12,22-24H,3,7-9H2,1H3,(H,21,25)
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341136
PNG
(CHEMBL1760548 | N-p-Methoxy cinnamoyl serotonin)
Show SMILES COc1ccc(\C=C\C(=O)NCCc2c[nH]c3ccc(O)cc23)cc1
Show InChI InChI=1S/C20H20N2O3/c1-25-17-6-2-14(3-7-17)4-9-20(24)21-11-10-15-13-22-19-8-5-16(23)12-18(15)19/h2-9,12-13,22-23H,10-11H2,1H3,(H,21,24)/b9-4+
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM16430
PNG
((2E)-3-phenylprop-2-enoic acid | CHEMBL27246 | Cin...)
Show SMILES OC(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM4375
PNG
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)
Show SMILES OC(=O)\C=C\c1ccc(O)c(O)c1
Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486691
PNG
(N-DIHYDROCINNAMOYL SEROTONIN)
Show SMILES Oc1ccc2[nH]cc(CCNC(=O)CCc3ccccc3)c2c1
Show InChI InChI=1S/C19H20N2O2/c22-16-7-8-18-17(12-16)15(13-21-18)10-11-20-19(23)9-6-14-4-2-1-3-5-14/h1-5,7-8,12-13,21-22H,6,9-11H2,(H,20,23)
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486690
PNG
(N-DIHYDRO-P-COUMAROYLSEROTONIN)
Show SMILES Oc1ccc(CCC(=O)NCCc2c[nH]c3ccc(O)cc23)cc1
Show InChI InChI=1S/C19H20N2O3/c22-15-4-1-13(2-5-15)3-8-19(24)20-10-9-14-12-21-18-7-6-16(23)11-17(14)18/h1-2,4-7,11-12,21-23H,3,8-10H2,(H,20,24)
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM10755
PNG
(14C-5-hydroxy tryptamine creatinine disulfate | 2-...)
Show SMILES NCCc1c[nH]c2ccc(O)cc12
Show InChI InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM4374
PNG
((2E)-3-(4-hydroxyphenyl)prop-2-enoic acid | (2E)-3...)
Show SMILES OC(=O)\C=C\c1ccc(O)cc1
Show InChI InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+
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n/an/a>3.00E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50333465
PNG
((2R,3R,4R,5R,6R)-5-((2R,3R,4R,5S,6R)-5-((2R,3R,4S,...)
Show SMILES C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)O[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-/s2
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n/an/a 4.20E+5n/an/an/an/an/an/a



Universidad Nacional Auto£?noma de Me£?xico

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase assessed as inhibition of p-nitrophenyl-alpha-D-glucopyranoside substrate hydrolysis after 35 mins by spectrosc...


J Nat Prod 74: 314-20 (2011)


Article DOI: 10.1021/np100447a
BindingDB Entry DOI: 10.7270/Q25D8S53
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50333465
PNG
((2R,3R,4R,5R,6R)-5-((2R,3R,4R,5S,6R)-5-((2R,3R,4S,...)
Show SMILES C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)O[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-/s2
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n/an/a 9.08E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate preincubated for 10 min before substrate addition and ...


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50341204
PNG
((Z)-3-butylidenephthalide | CHEMBL1765390)
Show SMILES CCC\C=C1\OC(=O)c2ccccc12
Show InChI InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8+
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n/an/a 2.35E+6n/an/an/an/an/an/a



Universidad Nacional Auto£?noma de Me£?xico

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase assessed as inhibition of p-nitrophenyl-alpha-D-glucopyranoside substrate hydrolysis after 35 mins by spectrosc...


J Nat Prod 74: 314-20 (2011)


Article DOI: 10.1021/np100447a
BindingDB Entry DOI: 10.7270/Q25D8S53
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50430740
PNG
(CHEMBL2333940 | Cedryl Acetate)
Show SMILES C[C@@H]1CC[C@H]2C(C)(C)[C@@H]3C[C@@]12CC[C@@]3(C)OC(C)=O
Show InChI InChI=1/C17H28O2/c1-11-6-7-13-15(3,4)14-10-17(11,13)9-8-16(14,5)19-12(2)18/h11,13-14H,6-10H2,1-5H3/t11-,13+,14+,16-,17+/s2
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n/an/a 9.40E+7n/an/an/an/an/an/a



University of Karachi

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using para-nitrophenyl alpha-D-glucopyranoside as substrate by spectrophotometric analysis


Eur J Med Chem 62: 764-70 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.036
BindingDB Entry DOI: 10.7270/Q27H1KZX
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50430739
PNG
(CHEMBL1974890 | Cedrol)
Show SMILES C[C@@H]1CC[C@H]2C(C)(C)[C@H]3C[C@@]12CC[C@@]3(C)O
Show InChI InChI=1S/C15H26O/c1-10-5-6-11-13(2,3)12-9-15(10,11)8-7-14(12,4)16/h10-12,16H,5-9H2,1-4H3/t10-,11+,12-,14-,15+/m1/s1
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n/an/a 1.30E+8n/an/an/an/an/an/a



University of Karachi

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using para-nitrophenyl alpha-D-glucopyranoside as substrate by spectrophotometric analysis


Eur J Med Chem 62: 764-70 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.036
BindingDB Entry DOI: 10.7270/Q27H1KZX
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM18351
PNG
((2R,3R,4R,5S)-2-(Hydroxymethyl)piperidine-3,4,5-tr...)
Show SMILES OC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
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n/an/a 4.26E+8n/an/an/an/an/an/a



University of Karachi

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using para-nitrophenyl alpha-D-glucopyranoside as substrate by spectrophotometric analysis


Eur J Med Chem 62: 764-70 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.036
BindingDB Entry DOI: 10.7270/Q27H1KZX
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50430738
PNG
(2Alpha,10Beta-Dihydroxycedryl Acetate | CHEMBL2333...)
Show SMILES CC(=O)O[C@]1(C)C[C@H](O)[C@@]23C[C@H]1C(C)(C)[C@@H]2CC[C@]3(C)O
Show InChI InChI=1/C17H28O4/c1-10(18)21-15(4)9-13(19)17-8-12(15)14(2,3)11(17)6-7-16(17,5)20/h11-13,19-20H,6-9H2,1-5H3/t11-,12-,13-,15+,16-,17+/s2
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n/an/a 6.90E+8n/an/an/an/an/an/a



University of Karachi

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using para-nitrophenyl alpha-D-glucopyranoside as substrate by spectrophotometric analysis


Eur J Med Chem 62: 764-70 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.036
BindingDB Entry DOI: 10.7270/Q27H1KZX
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50333465
PNG
((2R,3R,4R,5R,6R)-5-((2R,3R,4R,5S,6R)-5-((2R,3R,4S,...)
Show SMILES C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)O[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-/s2
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n/an/a 7.80E+8n/an/an/an/an/an/a



University of Karachi

Curated by ChEMBL


Assay Description
Inhibition of yeast alpha-glucosidase using para-nitrophenyl alpha-D-glucopyranoside as substrate by spectrophotometric analysis


Eur J Med Chem 62: 764-70 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.036
BindingDB Entry DOI: 10.7270/Q27H1KZX
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50093882
PNG
(3,4,5-Trihydroxy-benzoic acid 5,7-dihydroxy-2-(3,4...)
Show SMILES Oc1cc(O)c2CC(OC(=O)c3cc(O)c(O)c(O)c3)C(Oc2c1)c1cc(O)c(O)c(O)c1
Show InChI InChI=1/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2
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n/an/a 2.00E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486898
PNG
(BROUSSONOL E | Broussonol E | CHEBI:66727)
Show SMILES CC(C)=CCc1cc(cc(O)c1O)-c1oc2cc(O)c(CC=C(C)C)c(O)c2c(=O)c1O
Show InChI InChI=1S/C25H26O7/c1-12(2)5-7-14-9-15(10-18(27)21(14)28)25-24(31)23(30)20-19(32-25)11-17(26)16(22(20)29)8-6-13(3)4/h5-6,9-11,26-29,31H,7-8H2,1-4H3
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n/an/a 2.10E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50121026
PNG
(2-[3,4-Dihydroxy-5-(3-methyl-but-2-enyl)-phenyl]-8...)
Show SMILES CC(C)=CCc1cc(cc(O)c1O)-c1oc2c(c(O)cc(O)c2c(=O)c1O)C(C)(C)C=C
Show InChI InChI=1S/C25H26O7/c1-6-25(4,5)19-16(27)11-15(26)18-21(30)22(31)23(32-24(18)19)14-9-13(8-7-12(2)3)20(29)17(28)10-14/h6-7,9-11,26-29,31H,1,8H2,2-5H3
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n/an/a 3.60E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50241503
PNG
(2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-1-Benzopy...)
Show SMILES Oc1cc2oc(c(O)cc2c(=[OH+])c1)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H10O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-6,16-17,19-20H/p+1
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n/an/a 4.00E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM15236
PNG
(3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chr...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H
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n/an/a 5.00E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50085536
PNG
(3,4,5-Trihydroxybenzoate, X | 3,4,5-trihydroxybenz...)
Show SMILES OC(=O)c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C7H6O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,8-10H,(H,11,12)
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n/an/a 5.20E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50121025
PNG
((E)-1-[2,4-Dihydroxy-5-(3-methyl-but-2-enyl)-pheny...)
Show SMILES CC(C)=CCc1cc(C(=O)\C=C\c2ccc(O)c(O)c2)c(O)cc1O
Show InChI InChI=1S/C20H20O5/c1-12(2)3-6-14-10-15(19(24)11-18(14)23)16(21)7-4-13-5-8-17(22)20(25)9-13/h3-5,7-11,22-25H,6H2,1-2H3/b7-4+
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n/an/a 5.30E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM19459
PNG
(5,7-dihydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one...)
Show SMILES Oc1ccc(cc1)-c1coc2cc(O)cc(O)c2c1=O
Show InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H
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n/an/a 7.00E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM7460
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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n/an/a 7.00E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486905
PNG
(CHEMBL2235441)
Show SMILES C\C=C/Cc1c(CC=C(C)C)c(O)c(O)cc1C1CCc2cc(c(O)cc2O1)C(C)(C)C=C
Show InChI InChI=1S/C29H36O4/c1-7-9-10-20-21(13-11-18(3)4)28(32)25(31)16-22(20)26-14-12-19-15-23(29(5,6)8-2)24(30)17-27(19)33-26/h7-9,11,15-17,26,30-32H,2,10,12-14H2,1,3-6H3/b9-7-
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n/an/a 1.06E+10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486906
PNG
(BROUSSOCHALCONE B)
Show SMILES CC(C)=CCc1cc(C(=O)\C=C\c2ccc(O)cc2)c(O)cc1O
Show InChI InChI=1S/C20H20O4/c1-13(2)3-7-15-11-17(20(24)12-19(15)23)18(22)10-6-14-4-8-16(21)9-5-14/h3-6,8-12,21,23-24H,7H2,1-2H3/b10-6+
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n/an/a 1.11E+10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50187133
PNG
(3,4,5-Trihydroxy-benzoic acid methyl ester | CHEMB...)
Show SMILES COC(=O)c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C8H8O5/c1-13-8(12)4-2-5(9)7(11)6(10)3-4/h2-3,9-11H,1H3
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n/an/a 1.15E+10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486892
PNG
(CHEMBL2235108)
Show SMILES CC(C)=CCc1cc(C2CCc3ccc(O)cc3O2)c(CC=C(C)C)c(O)c1O
Show InChI InChI=1S/C25H30O4/c1-15(2)5-7-18-13-21(20(11-6-16(3)4)25(28)24(18)27)22-12-9-17-8-10-19(26)14-23(17)29-22/h5-6,8,10,13-14,22,26-28H,7,9,11-12H2,1-4H3
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n/an/a 1.20E+10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM7462
PNG
(3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-...)
Show SMILES Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O
Show InChI InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H
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n/an/a 1.20E+10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM50486893
PNG
(4-HYDROXYISOLONCHOCARPIN)
Show SMILES CC1(C)Oc2cc(O)c(cc2C=C1)C(=O)\C=C\c1ccc(O)cc1
Show InChI InChI=1S/C20H18O4/c1-20(2)10-9-14-11-16(18(23)12-19(14)24-20)17(22)8-5-13-3-6-15(21)7-4-13/h3-12,21,23H,1-2H3/b8-5+
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n/an/a 1.23E+10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
Alpha-glucosidase MAL62


(Saccharomyces cerevisiae)
BDBM7457
PNG
(2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-4H-chromen-4...)
Show SMILES Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H
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n/an/a 1.30E+10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of baker's yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate by spectrophotometry


Citation and Details
More data for this
Ligand-Target Pair
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