| Entry |
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| Name |
Calcitriol;
1alpha,25-Dihydroxyvitamin D3;
(1S,3R,5Z,7E)-9,10-Seco-5,7,10(19)-cholestatriene-1,3,25-triol
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| Formula |
C27H44O3
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| Exact mass |
416.329
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| Mol weight |
416.6365
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| Structure |
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| Remark |
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| Reaction |
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| Pathway |
| map04928 | Parathyroid hormone synthesis, secretion and action |
| map04961 | Endocrine and other factor-regulated calcium reabsorption |
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| Module |
| M00103 | Cholecalciferol biosynthesis |
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| Network |
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| Enzyme |
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| Brite |
Compounds with biological roles [BR:br08001]
Hormones and transmitters
Steroid hormones
Others
C01673 Calcitriol (Vitamin D)
Lipids [BR:br08002]
ST Sterol lipids
ST03 Secosteroids
ST0302 Vitamin D3 and derivatives
C01673 Calcitriol
Prodrugs [br08324.html]
C01673
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A11 VITAMINS
A11C VITAMIN A AND D, INCL. COMBINATIONS OF THE TWO
A11CC Vitamin D and analogues
A11CC04 Calcitriol
D00129 Calcitriol (JAN/USP/INN) <JP/US>
D DERMATOLOGICALS
D05 ANTIPSORIATICS
D05A ANTIPSORIATICS FOR TOPICAL USE
D05AX Other antipsoriatics for topical use
D05AX03 Calcitriol
D00129 Calcitriol (JAN/USP/INN) <JP/US>
USP drug classification [BR:br08302]
Dermatological Agents
Dermatological Agents, Other
Psoriasis Agents
Calcitriol
D00129 Calcitriol (JAN/USP/INN)
Metabolic Bone Disease Agents
Vitamin D-related Agents
Calcitriol
D00129 Calcitriol (JAN/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
3 Agents affecting metabolism
31 Vitamins
311 Vitamins A and D preparations
3112 Synthetic vitamin D preparations
D00129 Calcitriol (JAN/USP/INN)
Drug groups [BR:br08330]
Gastrointestinal agent
DG01607 Vitamin D derivatives
DG01606 Activated vitamin D3
D00129 Calcitriol
Musculo-skeletal system agent
DG03232 Osteoporosis agent
D00129 Calcitriol
Drug classes [BR:br08332]
Musculo-skeletal system agent
DG03232 Osteoporosis agent
D00129 Calcitriol
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Thyroid hormone like receptors
Vitamin D3 like receptor
NR1I1 (VDR)
D00129 Calcitriol (JAN/USP/INN) <JP/US>
Prodrugs [br08324.html]
D00129
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| Other DBs |
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| KCF data |
ATOM 30
1 C1x C 18.5200 -16.5451
2 C1y C 18.5200 -17.9130
3 C1x C 19.7074 -18.5969
4 C2y C 20.8881 -17.9130
5 C2y C 20.8881 -16.5451
6 C1y C 19.7074 -15.8612
7 C1x C 22.0826 -14.4589
8 C1x C 22.0826 -15.8267
9 C2y C 23.2700 -16.5106
10 C1x C 23.2700 -13.7750
11 C1z C 24.4505 -14.4589
12 C1y C 24.4448 -15.8267
13 C1x C 26.8138 -15.8368
14 C1x C 26.8197 -14.4689
15 C1y C 25.6382 -13.7801
16 C1c C 25.6439 -12.4122
17 C1b C 26.8217 -11.7302
18 C1b C 28.0031 -12.4142
19 C1b C 29.1844 -11.7370
20 C1d C 30.3657 -12.4209
21 C2b C 22.0904 -18.5652
22 C1a C 24.4385 -13.0911
23 C1a C 24.4603 -11.7265
24 C2b C 23.2399 -17.8599
25 O1a O 17.3358 -18.5974
26 C2a C 20.8806 -15.1704
27 C1a C 31.5993 -11.7107
28 C1a C 30.3643 -13.8008
29 O1a O 31.5732 -13.1181
30 O1a O 19.7098 -14.4292
BOND 32
1 2 3 1
2 15 16 1
3 3 4 1
4 16 17 1
5 7 8 1
6 17 18 1
7 8 9 1
8 18 19 1
9 9 12 1
10 19 20 1
11 9 24 2
12 11 10 1
13 24 21 1
14 10 7 1
15 4 5 1
16 11 22 1 #Up
17 5 6 1
18 16 23 1 #Down
19 6 1 1
20 1 2 1
21 11 12 1
22 13 14 1
23 21 4 2
24 14 15 1
25 15 11 1
26 2 25 1 #Up
27 12 13 1
28 5 26 2
29 20 27 1
30 20 28 1
31 20 29 1
32 6 30 1 #Down
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