Chem
J-GLOBAL ID：200907046338104278   Nikkaji number：J652.922D

7α,25-Dihydroxycholesterol

7α,25-ジヒドロキシコレステロール
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： C27H46O3
Molecular formula furigana： C27-H46-O3
Molecular weight： 418.662
InChI： InChI=1S/C27H46O3/c1-17(7-6-12-25(2,3)30)20-8-9-21-24-22(11-14-27(20,21)5)26(4)13-10-19(28)15-18(26)16-23(24)29/h16-17,19-24,28-30H,6-15H2,1-5H3/t17-,19+,20-,21+,22+,23-,24+,26+,27-/m1/s1
InChI key： BQMSKLCEWBSPPY-IKVTXIKFSA-N
SMILES： C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (4)：
  • コレスタ-5-エン-3β,7α,25-トリオール
  • 7α,25-ジヒドロキシコレステロール
  • (1R,3aS,3bS,4S,7S,9aR,9bS,11aR)-1-[(2R)-6-ヒドロキシ-6-メチルヘプタン-2-イル]-9a,11a-ジメチル-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-4,7-ジオール
  • (1R,3aS,3bS,4S,7S,9aR,9bS,11aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-4,7-diol
Other name (2)：
  • 7α,25-Dihydroxycholesterol
  • Cholest-5-ene-3β,7α,25-triol
KEGG COMPOUND： C15520
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