CHEBI:70479 - isopulegol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name isopulegol
Definition A natural product found in Citrus hystrix.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C10H18O
Net Charge 0
Average Mass 154.24930
Monoisotopic Mass 154.13577
InChI InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9+,10-/m1/s1
SMILES C[C@@H]1CC[C@H]([C@H](O)C1)C(C)=C
Metabolite of Species Details
Citrus hystrix (NCBI:txid170989) Found in exocarp (BTO:0000733). The hexane extract of dried and ground fruit peels See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing isopulegol (CHEBI:70479) has role metabolite (CHEBI:25212)
isopulegol (CHEBI:70479) is a p-menthane monoterpenoid (CHEBI:25186)
Synonyms Sources
(1R,3R,4S)-p-Menth-8-en-3-ol ChEBI
Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1R,2S,5R)- ChEBI
Manual Xref Database
HMDB0036078 HMDB
View more database links
Registry Number Type Source
89-79-2 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
20964319 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:monoterpenoid(CHEBI:25409); ISA:cyclohexanols(CHEBI:23480); ISA:organic hydroxy compound(CHEBI:33822);