Chem
J-GLOBAL ID：201707011341672141   Nikkaji number：J3.597.048G

(7Z)-9,10-Seco-19-norcholesta-5,7-diene-1α,3β,25-triol

(7Z)-9,10-セコ-19-ノルコレスタ-5,7-ジエン-1α,3β,25-トリオール
Substance type：
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
Molecular formula： C26H44O3
Molecular formula furigana： C26-H44-O3
Molecular weight： 404.635
InChI： InChI=1S/C26H44O3/c1-18(7-5-13-25(2,3)29)23-11-12-24-20(8-6-14-26(23,24)4)10-9-19-15-21(27)17-22(28)16-19/h9-10,18,21-24,27-29H,5-8,11-17H2,1-4H3/b20-10-/t18-,21-,22-,23-,24+,26-/m1/s1
InChI key： PKFBWEUIKKCWEW-RXSVZSMJSA-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[C@H](O)C3)/CCC[C@]12C
Systematic name  (3)：
  • (7Z)-9,10-セコ-19-ノルコレスタ-5,7-ジエン-1α,3β,25-トリオール
  • (1R,3R)-5-{2-[(1R,3aS,4Z,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-1,3-ジオール
  • (1R,3R)-5-{2-[(1R,3aS,4Z,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}cyclohexane-1,3-diol
Other name (1)：
  • (7Z)-9,10-Seco-19-norcholesta-5,7-diene-1α,3β,25-triol
Thsaurus map：
Thesaurus Map

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