Chem
J-GLOBAL ID:200907034213800304   Nikkaji number:J1.166.307I

5α-Cyclohexyl-2,3,3aβ,4,5,7aβ-hexahydro-1H-indene-4β-carboxylic acid 4α-cyclohexylcyclohexane-1β-yl ester

5α-シクロヘキシル-2,3,3aβ,4,5,7aβ-ヘキサヒドロ-1H-インデン-4β-カルボン酸4α-シクロヘキシルシクロヘキサン-1β-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: C28H44O2
Molecular formula furigana: C28-H44-O2
Molecular weight: 412.658
InChI: InChI=1S/C28H44O2/c29-28(30-24-17-14-21(15-18-24)20-8-3-1-4-9-20)27-25-13-7-12-23(25)16-19-26(27)22-10-5-2-6-11-22/h16,19-27H,1-15,17-18H2/t21-,23-,24-,25-,26-,27+/m0/s1
InChI key: HUEVFWWKBBNEHB-XMIRPNQRSA-N
SMILES: O=C(O[C@H]1CC[C@@H](CC1)C1CCCCC1)[C@@H]1[C@H]2CCC[C@H]2C=C[C@H]1C1CCCCC1
Systematic name  (3):
  • 5α-シクロヘキシル-2,3,3aβ,4,5,7aβ-ヘキサヒドロ-1H-インデン-4β-カルボン酸4α-シクロヘキシルシクロヘキサン-1β-イル
  • (1r,4r)-[1,1'-ビ(シクロヘキサン)]-4-イル (3aS,4R,5R,7aS)-5-シクロヘキシル-2,3,3a,4,5,7a-ヘキサヒドロ-1H-インデン-4-カルボキシラート
  • (1r,4r)-[1,1'-bi(cyclohexane)]-4-yl (3aS,4R,5R,7aS)-5-cyclohexyl-2,3,3a,4,5,7a-hexahydro-1H-indene-4-carboxylate
Other name (1):
  • 5α-Cyclohexyl-2,3,3aβ,4,5,7aβ-hexahydro-1H-indene-4β-carboxylic acid 4α-cyclohexylcyclohexane-1β-yl ester
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