3α-Dihydrocadambine

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For Research Use Only.

Category

Alkaloids

Cat.No.

NP0620

CAS

54483-84-0

Product Name

3α-Dihydrocadambine

Structure

Product Details

Description

3α-Dihydrocadambine is a monoterpenoid gluco-indole alkaloid isolated from Nauclea cadamba ROXB.

Synonyms

3-Dihydrocadambine; 3alpha-Dihydrocadambine

IUPAC Name

methyl (1S,15S,16S,17S,21S)-15-hydroxy-17-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-18-oxa-3,13-diazapentacyclo[11.9.0.02,10.04,9.016,21]docosa-2(10),4,6,8,19-pentaene-20-carboxylate

Molecular Weight

546.57

Molecular Formula

C27H34N2O10

Canonical SMILES

COC(=O)C1=COC(C2C1CC3C4=C(CCN3CC2O)C5=CC=CC=C5N4)OC6C(C(C(C(O6)CO)O)O)O

InChI

InChI=1S/C27H34N2O10/c1-36-25(35)15-11-37-26(39-27-24(34)23(33)22(32)19(10-30)38-27)20-14(15)8-17-21-13(6-7-29(17)9-18(20)31)12-4-2-3-5-16(12)28-21/h2-5,11,14,17-20,22-24,26-28,30-34H,6-10H2,1H3/t14-,17+,18-,19-,20+,22-,23+,24-,26+,27+/m1/s1

InChIKey

HNZGKRAKJFZQAY-SBAWYOAKSA-N

Purity

98%

Form

Powder

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