Chem
J-GLOBAL ID：200907003601387378   Nikkaji number：J18.005J

Cembrene A

センブレンA
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： C20H32
Molecular formula furigana： C20-H32
Molecular weight： 272.476
InChI： InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,20H,1,6-7,9-10,13-15H2,2-5H3/b17-8+,18-12+,19-11+
InChI key： VWSPQDDPRITBAM-GDVLXBNMSA-N
SMILES： CC(=C)C1CC/C(=C/CC/C(=C/CC/C(=C/C1)/C)/C)/C
Systematic name  (4)：
  • (1E,5E,9E,12R)-1,5,9-トリメチル-12-イソプロペニルシクロテトラデカ-1,5,9-トリエン
  • (R,1E,5E,9E)-1,5,9-トリメチル-12-(1-メチルエテニル)シクロテトラデカ-1,5,9-トリエン
  • (1E,5E,9E,12R)-1,5,9-トリメチル-12-(プロパ-1-エン-2-イル)シクロテトラデカ-1,5,9-トリエン
  • (1E,5E,9E,12R)-1,5,9-trimethyl-12-(prop-1-en-2-yl)cyclotetradeca-1,5,9-triene
Other name (10)：
  • センブレンA
  • ネオセンブレン
  • Cembrene A
  • Neocembrene
  • (R,1E,5E,9E)-1,5,9-Trimethyl-12-(1-methylethenyl)cyclotetradeca-1,5,9-triene
Show all
CAS registry number： 31570-39-5
KEGG COMPOUND： C09140
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