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CHEBI:10278 - α-eudesmol

ChEBI IDCHEBI:10278
ChEBI Nameα-eudesmol
Stars
ASCII Namealpha-eudesmol
DefinitionA eudesmane sesquiterpenoid in which the eudesmane skeleton carries a hydroxy substituent at C-11 and has a double bond between C-3 and C-4.
Last Modified12 October 2017
DownloadsMolfile
FormulaC15H26O
Net Charge0
Average Mass222.372
Monoisotopic Mass222.19837
SMILES[H][C@@]12C[C@H](C(C)(C)O)CC[C@@]1(C)CCC=C2C
InChIInChI=1S/C15H26O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h6,12-13,16H,5,7-10H2,1-4H3/t12-,13+,15-/m1/s1
InChIKeyFCSRUSQUAVXUKK-VNHYZAJKSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria japonica (ncbitaxon:3369) leaf (BTO:0000713) PubMed (23714012) Found in essential oil from leaves
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)
α-eudesmol (CHEBI:10278) has role volatile oil component (CHEBI:27311)
α-eudesmol (CHEBI:10278) is a eudesmane sesquiterpenoid (CHEBI:62508)
α-eudesmol (CHEBI:10278) is a octahydronaphthalenes (CHEBI:138397)
α-eudesmol (CHEBI:10278) is a tertiary alcohol (CHEBI:26878)
IUPAC Names 
2-[(2R,4aR,8aR)-4a,8-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-2-yl]propan-2-ol
eudesm-3-en-11-ol
Synonyms  Source
alpha-EudesmolKEGG COMPOUND
(2R,4aR,8aR)-1,2,3,4,4a,5,6,8a-octahydro-α,α,4a,8-tetramethyl-2-naphthalenemethanolChemIDplus
UniProt Name  Source
α-eudesmolUniProt
Manual XrefsDatabases
C09663KEGG COMPOUND
C00000163KNApSAcK
Registry NumbersSources
Reaxys:2329028Reaxys
CAS:473-16-5KEGG COMPOUND
CAS:473-16-5ChemIDplus