CHEBI:63443 - α-guaiene

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ChEBI Name α-guaiene
ChEBI ASCII Name alpha-guaiene
Definition A carbobicyclic compound and sesquiterpene that is 1,2,3,4,5,6,7,8-octahydroazulene which is substituted by methyl groups at positions 1 and 4 and by a (prop-1-en-2-yl group at position 7 (the 1S,4S,7R enantiomer).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C15H24
Net Charge 0
Average Mass 204.35110
Monoisotopic Mass 204.18780
InChI InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-13H,1,5-9H2,2-4H3/t11-,12-,13+/m0/s1
Metabolite of Species Details
Pogostemon cablin (NCBI:txid28511) Found in leaf (BTO:0000713). See: PubMed
Pogostemon cablin (NCBI:txid28511) Found in stem (BTO:0001300). See: PubMed
Roles Classification
Biological Role(s): volatile oil component
Any plant metabolite that is found naturally as a component of a volatile oil.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing α-guaiene (CHEBI:63443) has role plant metabolite (CHEBI:76924)
α-guaiene (CHEBI:63443) has role volatile oil component (CHEBI:27311)
α-guaiene (CHEBI:63443) is a carbobicyclic compound (CHEBI:36785)
α-guaiene (CHEBI:63443) is a sesquiterpene (CHEBI:35189)
Synonym Source
α-guaiene UniProt
Manual Xref Database
CPD-8749 MetaCyc
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Registry Numbers Types Sources
2247493 Reaxys Registry Number Reaxys
3691-12-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
12381106 PubMed citation Europe PMC
12575075 PubMed citation Europe PMC
1270568 PubMed citation Europe PMC
16970904 PubMed citation SUBMITTER
17107759 PubMed citation Europe PMC
19731610 PubMed citation Europe PMC
20046787 PubMed citation Europe PMC
20959422 PubMed citation SUBMITTER
21299133 PubMed citation Europe PMC
Last Modified
25 March 2015