Chem
J-GLOBAL ID:200907000139177592   Nikkaji number:J108.480A

(1R)-7α-Ethyl-1,2,3,4,4a,4bα,5,6,7,8,10,10aα-dodecahydro-1,4aβ,7-trimethyl-1α-phenanthrenecarboxylic acid methyl ester

(1R)-7α-エチル-1,2,3,4,4a,4bα,5,6,7,8,10,10aα-ドデカヒドロ-1,4aβ,7-トリメチル-1α-フェナントレンカルボン酸メチル
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: C21H34O2
Molecular formula furigana: C21-H34-O2
Molecular weight: 318.501
InChI: InChI=1S/C21H34O2/c1-6-19(2)13-10-16-15(14-19)8-9-17-20(16,3)11-7-12-21(17,4)18(22)23-5/h8,16-17H,6-7,9-14H2,1-5H3/t16-,17+,19-,20+,21+/m0/s1
InChI key: RPWGDFVMHDEOFF-GBMAXXPESA-N
SMILES: CC[C@@]1(C)CC[C@H]2C(=CC[C@@H]3[C@]2(C)CCC[C@@]3(C)C(=O)OC)C1
Systematic name  (3):
  • (1R)-7α-エチル-1,2,3,4,4a,4bα,5,6,7,8,10,10aα-ドデカヒドロ-1,4aβ,7-トリメチル-1α-フェナントレンカルボン酸メチル
  • メチル (1R,4aR,4bS,7S,10aR)-7-エチル-1,4a,7-トリメチル-1,2,3,4,4a,4b,5,6,7,8,10,10a-ドデカヒドロフェナントレン-1-カルボキシラート
  • methyl (1R,4aR,4bS,7S,10aR)-7-ethyl-1,4a,7-trimethyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydrophenanthrene-1-carboxylate
Other name (1):
  • (1R)-7α-Ethyl-1,2,3,4,4a,4bα,5,6,7,8,10,10aα-dodecahydro-1,4aβ,7-trimethyl-1α-phenanthrenecarboxylic acid methyl ester
CAS registry number: 3827-30-3
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