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CHEBI:129 - (−)-β-phellandrene

ChEBI IDCHEBI:129
ChEBI Name(−)-β-phellandrene
Stars
ASCII Name(-)-beta-phellandrene
DefinitionA β-phellandrene in which the chiral centre has R configuration.
Last Modified23 October 2015
DownloadsMolfile
FormulaC10H16
Net Charge0
Average Mass136.238
Monoisotopic Mass136.12520
SMILES[H][C@@]1(C(C)C)C=CC(=C)CC1
InChIInChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8,10H,3,5,7H2,1-2H3/t10-/m1/s1
InChIKeyLFJQCDVYDGGFCH-SNVBAGLBSA-N
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
(−)-β-phellandrene (CHEBI:129) has role plant metabolite (CHEBI:76924)
(−)-β-phellandrene (CHEBI:129) is a β-phellandrene (CHEBI:48741)
(−)-β-phellandrene (CHEBI:129) is enantiomer of (+)-β-phellandrene (CHEBI:53)
Incoming Relation(s)
(+)-β-phellandrene (CHEBI:53) is enantiomer of (−)-β-phellandrene (CHEBI:129)
IUPAC Names 
(4R)-p-mentha-1(7),2-diene
(6R)-3-methylidene-6-(propan-2-yl)cyclohex-1-ene
Synonyms  Source
(-)-beta-PhellandreneKEGG COMPOUND
(−)-p-mentha-1(7),2-dieneChEBI
(R)-3-isopropyl-6-methylenecyclohexeneChEBI
β-phellandrene l-formChemIDplus
(−)-3-methylene-6-(1-methylethyl)cyclohexeneChemIDplus
(3R)-3-isopropyl-6-methylenecyclohexeneIUPAC
UniProt Name  Source
(−)-β-phellandreneUniProt
Manual XrefsDatabases
C11392KEGG COMPOUND
C00010873KNApSAcK
CPD-8768MetaCyc
HMDB0041633HMDB
Registry NumbersSources
Beilstein:3194594Beilstein
CAS:6153-17-9KEGG COMPOUND
CAS:6153-17-9ChemIDplus