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CHEBI:10417 - β-eudesmol

ChEBI IDCHEBI:10417
ChEBI Nameβ-eudesmol
Stars
ASCII Namebeta-eudesmol
DefinitionA carbobicyclic compound that is trans-decalin substituted at positions 2, 4a, and 8 by 2-hydroxypropan-2-yl, methyl and methylidene groups, respectively (the 2R,4aR,8aS-diastereoisomer).
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H26O
Net Charge0
Average Mass222.372
Monoisotopic Mass222.19837
SMILES[H][C@@]12C[C@H](C(C)(C)O)CC[C@@]1(C)CCCC2=C
InChIInChI=1S/C15H26O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h12-13,16H,1,5-10H2,2-4H3/t12-,13+,15-/m1/s1
InChIKeyBOPIMTNSYWYZOC-VNHYZAJKSA-N
Roles Classification
Biological Role:
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
ChEBI Ontology
Outgoing Relation(s)
β-eudesmol (CHEBI:10417) has role volatile oil component (CHEBI:27311)
β-eudesmol (CHEBI:10417) is a carbobicyclic compound (CHEBI:36785)
β-eudesmol (CHEBI:10417) is a eudesmane sesquiterpenoid (CHEBI:62508)
β-eudesmol (CHEBI:10417) is a tertiary alcohol (CHEBI:26878)
IUPAC Names 
2-[(2R,4aR,8aS)-4a-methyl-8-methylidenedecahydronaphthalen-2-yl]propan-2-ol
eudesm-4(14)-en-11-ol
Synonyms  Source
(2R,4aR,8aS)-decahydro-8-methylene-α,α,4a-trimethyl-2-naphthylmethanolChEBI
beta-EudesmolKEGG COMPOUND
β-selinenolChemIDplus
UniProt Name  Source
β-eudesmolUniProt
Manual XrefsDatabases
C00000164KNApSAcK
C09664KEGG COMPOUND
CPD-11432MetaCyc
Registry NumbersSources
Reaxys:5735560Reaxys
CAS:473-15-4KEGG COMPOUND
CAS:473-15-4ChemIDplus
Citations