Chem
J-GLOBAL ID：201707005823149900   Nikkaji number：J3.635.352J

(1E,3E,5E,7E,9E,11E)-1,12-Bis(2,6,6-trimethyl-1-cyclohexenyl)-3,7,10-trimethyl-1,3,5,7,9,11-dodecahexaene

(1E,3E,5E,7E,9E,11E)-1,12-ビス(2,6,6-トリメチル-1-シクロヘキセニル)-3,7,10-トリメチル-1,3,5,7,9,11-ドデカヘキサエン
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： C33H48
Molecular formula furigana： C33-H48
Molecular weight： 444.747
InChI： InChI=1S/C33H48/c1-25(17-18-27(3)20-22-31-29(5)16-12-24-33(31,8)9)13-10-14-26(2)19-21-30-28(4)15-11-23-32(30,6)7/h10,13-14,17-22H,11-12,15-16,23-24H2,1-9H3/b13-10+,21-19+,22-20+,25-17+,26-14+,27-18+
InChI key： NBZDQKZIQXMBNQ-JKJWEBARSA-N
SMILES： C/C(=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C
Systematic name  (3)：
  • (1E,3E,5E,7E,9E,11E)-1,12-ビス(2,6,6-トリメチル-1-シクロヘキセニル)-3,7,10-トリメチル-1,3,5,7,9,11-ドデカヘキサエン
  • 1,3,3-トリメチル-2-[(1E,3E,5E,7E,9E,11E)-3,7,10-トリメチル-12-(2,6,6-トリメチルシクロヘキサ-1-エン-1-イル)ドデカ-1,3,5,7,9,11-ヘキサエン-1-イル]シクロヘキサ-1-エン
  • 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E)-3,7,10-trimethyl-12-(2,6,6-trimethylcyclohex-1-en-1-yl)dodeca-1,3,5,7,9,11-hexaen-1-yl]cyclohex-1-ene
Other name (1)：
  • (1E,3E,5E,7E,9E,11E)-1,12-Bis(2,6,6-trimethyl-1-cyclohexenyl)-3,7,10-trimethyl-1,3,5,7,9,11-dodecahexaene
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