CHEBI:87574 - (Z)-β-ocimene

ChEBI IDCHEBI:87574
ChEBI Name(Z)-β-ocimene
Stars
ASCII Name(Z)-beta-ocimene
DefinitionA β-ocimene that consists of octa-1,3,6-triene bearing two methyl substituents at positions 3 and 7 (the 3Z-isomer).
Last Modified17 September 2021
Submitternamrata
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FormulaC10H16
Net Charge0
Average Mass136.238
Monoisotopic Mass136.12520
SMILESC=C/C(C)=C\CC=C(C)C
InChIInChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7-8H,1,6H2,2-4H3/b10-8-
InChIKeyIHPKGUQCSIINRJ-NTMALXAHSA-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)
(Z)-β-ocimene (CHEBI:87574) has role plant metabolite (CHEBI:76924)
(Z)-β-ocimene (CHEBI:87574) is a β-ocimene (CHEBI:10436)
IUPAC Name 
(3Z)-3,7-dimethylocta-1,3,6-triene
Synonyms  Source
β-cis-ocimeneNIST Chemistry WebBook
cis-3,7-dimethyl-1,3,6-octatrieneNIST Chemistry WebBook
UniProt Name  Source
(Z)-β-ocimeneUniProt
Registry NumbersSources
Reaxys:1839944Reaxys
CAS:3338-55-4ChemIDplus
CAS:3338-55-4NIST Chemistry WebBook
Citations