Chem
J-GLOBAL ID:200907010802241556   Nikkaji number:J1.166.269B

(2E,7E,9E)-2,7,9-Hexadecatrienoic acid 4α-cyclohexylcyclohexane-1β-yl ester

(2E,7E,9E)-2,7,9-ヘキサデカトリエン酸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: C28H46O2
Molecular formula furigana: C28-H46-O2
Molecular weight: 414.674
InChI: InChI=1S/C28H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-28(29)30-27-23-21-26(22-24-27)25-18-15-14-16-19-25/h7-10,17,20,25-27H,2-6,11-16,18-19,21-24H2,1H3/b8-7+,10-9+,20-17+/t26-,27-
InChI key: PBTYGEZQUGGXIA-PYSNKFKLSA-N
SMILES: CCCCCC/C=C/C=C/CCC/C=C/C(=O)O[C@H]1CC[C@@H](CC1)C1CCCCC1
Systematic name  (3):
  • (2E,7E,9E)-2,7,9-ヘキサデカトリエン酸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 (2E,7E,9E)-ヘキサデカ-2,7,9-トリエノアート
  • (1r,4r)-[1,1'-bi(cyclohexane)]-4-yl (2E,7E,9E)-hexadeca-2,7,9-trienoate
Other name (1):
  • (2E,7E,9E)-2,7,9-Hexadecatrienoic acid 4α-cyclohexylcyclohexane-1β-yl ester
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