Chem
J-GLOBAL ID：200907036573488592
Nikkaji number：J2.367A
Vitamin D3
ビタミンD3
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C27H44O
Molecular formula furigana： C27-H44-O
Molecular weight： 384.648
InChI：
InChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h12-13,19,21,24-26,28H,3,6-11,14-18H2,1-2,4-5H3/b22-12+,23-13-/t21-,24+,25-,26+,27-/m1/s1
InChI key：
QYSXJUFSXHHAJI-YRZJJWOYSA-N
SMILES：
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@@H](O)CCC3=C)/CCC[C@]12C
Systematic name (5)：
- コレカルシフェロール
- (5Z,7E)-9,10-セココレスタ-5,7,10(19)-トリエン-3β-オール
- (3S,5Z,7E)-9,10-セココレスタ-5,7,10(19)-トリエン-3-オール
- (1S,3Z)-3-{2-[(1R,3aS,4E,7aR)-7a-メチル-1-[(2R)-6-メチルヘプタン-2-イル]-オクタヒドロ-1H-インデン-4-イリデン]エチリデン}-4-メチリデンシクロヘキサン-1-オール
- (1S,3Z)-3-{2-[(1R,3aS,4E,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexan-1-ol
- ビタミンD3
- オレオビタミンD3
- 活性7-デヒドロコレステロール
- Vitamin D3
- Cholecalciferol
Show all
Regulation number (4)：
- EINECS2006732
- FZ5650000
- (9)-1054
- TSCA(67-97-0)
KEGG DRUG：
D00188
KEGG COMPOUND：
C05443
Application (1)：
rodenticide
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