CHEBI:50027 - sabinene

ChEBI IDCHEBI:50027
ChEBI Namesabinene
Stars
DefinitionA thujene that is a bicyclic monoterpene isolated from the essential oils of various plant species.
Last Modified8 September 2021
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC10H16
Net Charge0
Average Mass136.238
Monoisotopic Mass136.12520
SMILESC=C1CCC2(C(C)C)CC12
InChIInChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h7,9H,3-6H2,1-2H3
InChIKeyNDVASEGYNIMXJL-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)
sabinene (CHEBI:50027) has role plant metabolite (CHEBI:76924)
sabinene (CHEBI:50027) is a thujene (CHEBI:50030)
Incoming Relation(s)
(+)-sabinene (CHEBI:50029) is a sabinene (CHEBI:50027)
(−)-sabinene (CHEBI:50028) is a sabinene (CHEBI:50027)
IUPAC Names 
4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexane
thuj-4(10)-ene
Synonyms  Source
1-isopropyl-4-methylenebicyclo[3.1.0]hexaneNIST Chemistry WebBook
4(10)-thujeneNIST Chemistry WebBook
4-methylene-1-(1-methylethyl)bicyclo[3.1.0]hexaneNIST Chemistry WebBook
SabinenKEGG COMPOUND
SabinenChemIDplus
UniProt Name  Source
sabineneUniProt
Manual XrefsDatabases
C16777KEGG COMPOUND
CPD-4893MetaCyc
SabineneWikipedia
Registry NumbersSources
Reaxys:2038283Reaxys
CAS:3387-41-5KEGG COMPOUND
CAS:3387-41-5ChemIDplus
CAS:3387-41-5NIST Chemistry WebBook
Citations