Chem
J-GLOBAL ID：200907031059648562   Nikkaji number：J127.307H

A-Nor-5α-cholestan-2-one

A-ノル-5α-コレスタン-2-オン
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： C26H44O
Molecular formula furigana： C26-H44-O
Molecular weight： 372.637
InChI： InChI=1S/C26H44O/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(27)16-26(19,5)24(21)13-14-25(22,23)4/h17-19,21-24H,6-16H2,1-5H3/t18-,19+,21+,22-,23+,24+,25-,26+/m1/s1
InChI key： YPDLLJYJSWXQMO-QIIFCYCGSA-N
SMILES： CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)C[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • A-ノル-5α-コレスタン-2-オン
  • (1S,2S,6S,9R,10S,13R,14R)-2,14-ジメチル-13-[(2R)-6-メチルヘプタン-2-イル]テトラシクロ[7.7.0.02,6.010,14]ヘキサデカン-4-オン
  • (1S,2S,6S,9R,10S,13R,14R)-2,14-dimethyl-13-[(2R)-6-methylheptan-2-yl]tetracyclo[7.7.0.02,6.010,14]hexadecan-4-one
Other name (1)：
  • A-Nor-5α-cholestan-2-one
CAS registry number： 2310-36-3
KEGG COMPOUND： C15292
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