| Entry |
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| Name |
Vitamin D2;
Ergocalciferol
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| Formula |
C28H44O
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| Exact mass |
396.3392
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| Mol weight |
396.6484
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| Structure |
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| Remark |
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| Reaction |
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| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
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| Module |
| M00102 | Ergocalciferol biosynthesis, squalene 2,3-epoxide => ergosterol/ergocalciferol |
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| Brite |
Compounds with biological roles [BR:br08001]
Vitamins and cofactors
Vitamins
Fat-soluble vitamins
C05441 Ergocalciferol (Vitamin D2)
Lipids [BR:br08002]
ST Sterol lipids
ST03 Secosteroids
ST0301 Vitamin D2 and derivatives
C05441 Vitamin D2
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
A11CC01 Ergocalciferol
D00187 Ergocalciferol (JP17/USP) <US>
Classification of Japanese OTC drugs [BR:br08313]
Nourishing tonics and health supplements
39 Vitamin AD based drugs
D00187 Ergocalciferol (JP17/USP)
Risk category of Japanese OTC drugs [BR:br08312]
Second-class OTC drugs
Inorganic and organic chemicals
Ergocalciferol or Cholecalciferol
D00187 Ergocalciferol (JP17/USP)
Third-class OTC drugs
Inorganic and organic chemicals
Ergocalciferol
D00187 Ergocalciferol (JP17/USP)
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Thyroid hormone like receptors
Vitamin D3 like receptor
NR1I1 (VDR)
D00187 Ergocalciferol (JP17/USP) <US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D00187 Ergocalciferol
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| Other DBs |
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| KCF data |
ATOM 29
1 C1z C 26.0840 -19.2948
2 C1y C 26.0781 -20.6545
3 C1y C 27.2642 -18.6237
4 C1x C 24.9210 -18.6179
5 C1a C 26.0724 -17.9411
6 C2y C 24.9210 -21.3314
7 C1x C 28.4331 -20.6603
8 C1x C 28.4447 -19.3065
9 C1c C 27.2526 -17.2640
10 C1x C 23.7405 -19.2948
11 C2b C 24.9210 -22.6855
12 C1x C 23.7405 -20.6545
13 C2b C 28.4272 -16.5755
14 C1a C 26.0724 -16.5928
15 C2b C 23.7464 -23.3681
16 C2b C 29.6018 -17.2409
17 C1c C 30.7763 -16.5525
18 C1c C 31.9508 -17.2236
19 C1a C 30.7647 -15.1986
20 C1a C 33.1253 -16.5350
21 C1a C 31.9623 -18.5775
22 C2y C 23.7464 -24.7648
23 C1x C 22.5242 -25.4702
24 C1y C 22.5240 -26.8669
25 C1x C 23.7335 -27.5655
26 C1x C 24.9557 -26.8600
27 C2y C 24.9559 -25.4633
28 C2a C 26.1656 -24.7649
29 O1a O 21.3143 -27.5653
BOND 31
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 6 11 2
11 6 12 1
12 9 13 1
13 9 14 1 #Down
14 11 15 1
15 13 16 2
16 16 17 1
17 17 18 1
18 17 19 1 #Down
19 18 20 1
20 18 21 1
21 7 8 1
22 10 12 1
23 15 22 2
24 22 23 1
25 23 24 1
26 24 25 1
27 25 26 1
28 26 27 1
29 22 27 1
30 27 28 2
31 24 29 1 #Down
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