Chem
J-GLOBAL ID：200907005942435934   Nikkaji number：J82.294I

Sclaren

スクラレン
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： C20H32
Molecular formula furigana： C20-H32
Molecular weight： 272.476
InChI： InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,17-18H,1-3,8-14H2,4-6H3/t17-,18-,20+/m0/s1
InChI key： KYLKKZSVPLUGCC-CMKODMSKSA-N
SMILES： CC1(C)CCC[C@]2(C)[C@@H](CCC(=C)C=C)C(=C)CC[C@@H]12
Systematic name  (4)：
  • ラブダ-8(20),13(16),14-トリエン
  • (4aS,8aα)-デカヒドロ-1,1,4aβ-トリメチル-6-メチレン-5β-(3-メチレン-4-ペンテニル)ナフタレン
  • (4aS,5S,8aS)-1,1,4a-トリメチル-6-メチリデン-5-(3-メチリデンペンタ-4-エン-1-イル)-デカヒドロナフタレン
  • (4aS,5S,8aS)-1,1,4a-trimethyl-6-methylidene-5-(3-methylidenepent-4-en-1-yl)-decahydronaphthalene
Other name (5)：
  • Sclarene
  • スクラレン
  • Sclaren
  • Labda-8(20),13(16),14-triene
  • (4aS,8aα)-Decahydro-1,1,4aβ-trimethyl-6-methylene-5β-(3-methylene-4-pentenyl)naphthalene
CAS registry number： 511-02-4
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