Chem
J-GLOBAL ID：200907010032521709
Nikkaji number：J624.673G
1α,2α,25-Trihydroxy-19-norcholecalciferol
1α,2α,25-トリヒドロキシ-19-ノルコレカルシフェロール
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： C26H44O4
Molecular formula furigana： C26-H44-O4
Molecular weight： 420.634
InChI：
InChI=1S/C26H44O4/c1-17(7-5-13-25(2,3)30)20-11-12-21-19(8-6-14-26(20,21)4)10-9-18-15-22(27)24(29)23(28)16-18/h9-10,17,20-24,27-30H,5-8,11-16H2,1-4H3/b18-9-,19-10+/t17-,20-,21+,22-,23-,24?,26-/m1/s1
InChI key：
CAGYDFRJDSWOLS-ZLODROQASA-N
SMILES：
C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@@H](O)C(O)[C@H](O)C3)/CCC[C@]12C
Systematic name (5)：
- 1α,2α,25-トリヒドロキシ-19-ノルコレカルシフェロール
- 1α,2β,25-トリヒドロキシ-19-ノルコレカルシフェロール
- (7E)-19-ノル-9,10-セココレスタ-5,7-ジエン-1α,2β,3β,25-テトラオール
- (1R,3R)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R)-6-ヒドロキシ-6-メチルヘプタン-2-イル]-7a-メチル-オクタヒドロ-1H-インデン-4-イリデン]エチリデン}シクロヘキサン-1,2,3-トリオール
- (1R,3R)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}cyclohexane-1,2,3-triol
- 1α,2α,25-Trihydroxy-19-norcholecalciferol
- 1α,2β,25-Trihydroxy-19-norcholecalciferol
- (7E)-19-Nor-9,10-secocholesta-5,7-diene-1α,2β,3β,25-tetrol
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