Chem
J-GLOBAL ID：200907024010027434   Nikkaji number：J19.045D

Minaxolone

ミナキソロン
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： C25H43NO3
Molecular formula furigana： C25-H43-N-O3
Molecular weight： 405.623
InChI： InChI=1S/C25H43NO3/c1-7-29-22-14-24(3)16(12-21(22)28)8-9-17-19-11-10-18(15(2)27)25(19,4)13-20(23(17)24)26(5)6/h16-23,28H,7-14H2,1-6H3/t16-,17-,18+,19-,20+,21-,22-,23+,24-,25+/m0/s1
InChI key： NCGLTZSBTFVVAW-KNXRZYMVSA-N
SMILES： CCO[C@H]1C[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(=O)C)[C@@]4(C)C[C@H]([C@H]23)N(C)C)C[C@@H]1O
Systematic name  (3)：
  • 11α-(ジメチルアミノ)-2β-エトキシ-3α-ヒドロキシ-5α-プレグナン-20-オン
  • 1-[(1S,3aS,3bS,5aS,7S,8S,9aS,9bS,10R,11aS)-10-(ジメチルアミノ)-8-エトキシ-7-ヒドロキシ-9a,11a-ジメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-1-イル]エタン-1-オン
  • 1-[(1S,3aS,3bS,5aS,7S,8S,9aS,9bS,10R,11aS)-10-(dimethylamino)-8-ethoxy-7-hydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]ethan-1-one
Other name (4)：
  • ミナキソロン
  • CC-112933
  • Minaxolone
  • 11α-(Dimethylamino)-2β-ethoxy-3α-hydroxy-5α-pregnan-20-one
CAS registry number： 62571-87-3
KEGG DRUG： D05041
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