Chem
J-GLOBAL ID:200907025406693573   Nikkaji number:J1.103.314H

6α-Bromocholest-4-en-3-one

6α-ブロモコレスタ-4-エン-3-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: C27H43BrO
Molecular formula furigana: C27-H43-BR-O
Molecular weight: 463.544
InChI: InChI=1S/C27H43BrO/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(28)24-15-19(29)11-13-27(24,5)23(20)12-14-26(21,22)4/h15,17-18,20-23,25H,6-14,16H2,1-5H3/t18-,20+,21-,22+,23+,25+,26-,27-/m1/s1
InChI key: SMYHXVUYHYXRCN-FQIKLQBFSA-N
SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@H](Br)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3):
  • 6α-ブロモコレスタ-4-エン-3-オン
  • (1R,3aS,3bS,5S,9aR,9bS,11aR)-5-ブロモ-9a,11a-ジメチル-1-[(2R)-6-メチルヘプタン-2-イル]-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オン
  • (1R,3aS,3bS,5S,9aR,9bS,11aR)-5-bromo-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (1):
  • 6α-Bromocholest-4-en-3-one
Thsaurus map:

Return to Previous Page