Chem
J-GLOBAL ID：201007088549869608   Nikkaji number：J2.791.490J

3β,21-Dihydroxy-4,4,14-trimethyl-5α-pregn-8-en-20-one

3β,21-ジヒドロキシ-4,4,14-トリメチル-5α-プレグナ-8-エン-20-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： C24H38O3
Molecular formula furigana： C24-H38-O3
Molecular weight： 374.565
InChI： InChI=1S/C24H38O3/c1-21(2)19-7-6-16-15(22(19,3)11-10-20(21)27)8-12-24(5)17(18(26)14-25)9-13-23(16,24)4/h17,19-20,25,27H,6-14H2,1-5H3/t17-,19+,20+,22-,23+,24-/m1/s1
InChI key： KUZAKLLYYNJTRA-CEGYNPMNSA-N
SMILES： C[C@]12CCC3=C(CC[C@H]4C(C)(C)[C@@H](O)CC[C@]34C)[C@]1(C)CC[C@@H]2C(=O)CO
Systematic name  (3)：
  • 3β,21-ジヒドロキシ-4,4,14-トリメチル-5α-プレグナ-8-エン-20-オン
  • 1-[(1S,3aR,5aR,7S,9aS,11aR)-7-ヒドロキシ-3a,6,6,9a,11a-ペンタメチル-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1-イル]-2-ヒドロキシエタン-1-オン
  • 1-[(1S,3aR,5aR,7S,9aS,11aR)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-hydroxyethan-1-one
Other name (2)：
  • 3β,21-Dihydroxy-4,4,14-trimethyl-5α-pregna-8-ene-20-one
  • 3β,21-Dihydroxy-4,4,14-trimethyl-5α-pregn-8-en-20-one
KEGG COMPOUND： C14991
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