Chem
J-GLOBAL ID:200907039165847460   Nikkaji number:J397.674B

18-Hydroxycortisol

18-ヒドロキシコルチソール
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: C21H30O6
Molecular formula furigana: C21-H30-O6
Molecular weight: 378.465
InChI: InChI=1S/C21H30O6/c1-19-6-4-13(24)8-12(19)2-3-14-15-5-7-21(27,17(26)10-22)20(15,11-23)9-16(25)18(14)19/h8,14-16,18,22-23,25,27H,2-7,9-11H2,1H3/t14-,15-,16-,18+,19-,20+,21-/m0/s1
InChI key: HESFZGWRDUVOMS-UKSDXMLSSA-N
SMILES: C[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(CO)C[C@H](O)[C@H]21
Systematic name  (3):
  • 18-ヒドロキシコルチソール
  • (1R,3aS,3bS,9aR,9bS,10S,11aS)-1,10-ジヒドロキシ-1-(2-ヒドロキシアセチル)-11a-(ヒドロキシメチル)-9a-メチル-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,9aR,9bS,10S,11aS)-1,10-dihydroxy-1-(2-hydroxyacetyl)-11a-(hydroxymethyl)-9a-methyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (2):
  • 18-Hydroxycortisol
  • 18-ヒドロキシコルチゾール
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