Chem
J-GLOBAL ID:200907080754491179   Nikkaji number:J783.965K

N-Phenylcarbamic acid 4,4,8,14-tetramethyl-20-oxo-18-nor-5α-pregn-13(17)-en-3β-yl ester

N-フェニルカルバミン酸4,4,8,14-テトラメチル-20-オキソ-18-ノル-5α-プレグナ-13(17)-エン-3β-イル
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: C31H43NO3
Molecular formula furigana: C31-H43-N-O3
Molecular weight: 477.689
InChI: InChI=1S/C31H43NO3/c1-20(33)22-14-18-30(5)23(22)12-13-25-29(4)17-16-26(28(2,3)24(29)15-19-31(25,30)6)35-27(34)32-21-10-8-7-9-11-21/h7-11,24-26H,12-19H2,1-6H3,(H,32,34)/t24-,25+,26-,29-,30+,31+/m0/s1
InChI key: NFWNTFRCGGDLGX-LVMULPTPSA-N
SMILES: CC(=O)C1=C2CC[C@@H]3[C@@]4(C)CC[C@H](OC(=O)Nc5ccccc5)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]2(C)CC1
Systematic name  (3):
  • N-フェニルカルバミン酸4,4,8,14-テトラメチル-20-オキソ-18-ノル-5α-プレグナ-13(17)-エン-3β-イル
  • (3aS,3bR,5aR,7S,9aR,9bR)-1-アセチル-3a,3b,6,6,9a-ペンタメチル-2H,3H,3aH,3bH,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H-シクロペンタ[a]フェナントレン-7-イル N-フェニルカルバマート
  • (3aS,3bR,5aR,7S,9aR,9bR)-1-acetyl-3a,3b,6,6,9a-pentamethyl-2H,3H,3aH,3bH,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H-cyclopenta[a]phenanthren-7-yl N-phenylcarbamate
Other name (1):
  • N-Phenylcarbamic acid 4,4,8,14-tetramethyl-20-oxo-18-nor-5α-pregn-13(17)-en-3β-yl ester
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