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CHEBI:50025 - β-pinene

ChEBI IDCHEBI:50025
ChEBI Nameβ-pinene
Stars
ASCII Namebeta-pinene
DefinitionAn isomer of pinene with an exocyclic double bond. It is a component of essential oils from many plants.
Secondary ChEBI IDsCHEBI:10438, CHEBI:22853
Last Modified9 March 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC10H16
Net Charge0
Average Mass136.238
Monoisotopic Mass136.12520
SMILESC=C1CCC2CC1C2(C)C
InChIInChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3
InChIKeyWTARULDDTDQWMU-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
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-pinene (CHEBI:50025) has role plant metabolite (CHEBI:76924)
β-pinene (CHEBI:50025) is a pinene (CHEBI:17187)
Incoming Relation(s)
pinen-10-yl vicianoside (CHEBI:132794) has functional parent β-pinene (CHEBI:50025)
(+)-β-pinene (CHEBI:50026) is a β-pinene (CHEBI:50025)
(−)-β-pinene (CHEBI:28359) is a β-pinene (CHEBI:50025)
IUPAC Names 
6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane
pin-2(10)-ene
Synonyms  Source
beta-PineneKEGG COMPOUND
6,6-dimethyl-2-methylenebicyclo[3.1.1]heptaneNIST Chemistry WebBook
nopineneNIST Chemistry WebBook
pseudopineneNIST Chemistry WebBook
2(10)-pineneChemIDplus
UniProt Name  Source
β-pineneUniProt
Manual XrefsDatabases
C09882KEGG COMPOUND
LMPR0102120018LIPID MAPS
CPD-3221MetaCyc
HMDB0036560HMDB
Beta-pineneWikipedia
C00000816KNApSAcK
Registry NumbersSources
Reaxys:1362266Reaxys
CAS:127-91-3KEGG COMPOUND
CAS:127-91-3NIST Chemistry WebBook
CAS:127-91-3ChemIDplus
Citations