CHEBI:15420 - perillyl alcohol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name perillyl alcohol
ChEBI ID CHEBI:15420
Definition A limonene monoterpenoid consists of a cyclohexene ring substituted by a hydroxymethyl and a prop-1-en-2-yl group at positions 1 and 4 respectively. It is a constituent of a variety of essential oils including lavender.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:18496, CHEBI:8022, CHEBI:14772
Supplier Information ChemicalBook:CB1353242, eMolecules:513262, ZINC000100018612
Download Molfile XML SDF
Formula C10H16O
Net Charge 0
Average Mass 152.23344
Monoisotopic Mass 152.12012
InChI InChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10-11H,1,4-7H2,2H3
InChIKey NDTYTMIUWGWIMO-UHFFFAOYSA-N
SMILES CC(=C)C1CCC(CO)=CC1
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
volatile oil component
Any plant metabolite that is found naturally as a component of a volatile oil.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing perillyl alcohol (CHEBI:15420) has role plant metabolite (CHEBI:76924)
perillyl alcohol (CHEBI:15420) has role volatile oil component (CHEBI:27311)
perillyl alcohol (CHEBI:15420) is a limonene monoterpenoid (CHEBI:25040)
Incoming (R)-(+)-perillyl alcohol (CHEBI:145806) is a perillyl alcohol (CHEBI:15420)
(S)-(−)-perillyl alcohol (CHEBI:10782) is a perillyl alcohol (CHEBI:15420)
IUPAC Name
[4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol
Synonyms Sources
1-Hydroxymethyl-4-isopropenyl-1-cyclohexene ChemIDplus
1-perillalcohol NIST Chemistry WebBook
4-(1-Methylethenyl)-1-cyclohexene-1-methanol ChemIDplus
4-Isopropenyl-1-cyclohexene carbinol ChemIDplus
4-Isopropenylcyclohex-1-en-1-ylmethanol ChemIDplus
dihydrocuminyl alcoholn NIST Chemistry WebBook
Isocarveol ChemIDplus
p-Mentha-1,8-dien-7-ol ChemIDplus
Perilla alcohol ChemIDplus
Perillol ChemIDplus
perillyl alcohol UniProt
Manual Xrefs Databases
HMDB0003634 HMDB
Perillyl-Alcohols MetaCyc
View more database links
Registry Numbers Types Sources
2044612 Reaxys Registry Number Reaxys
536-59-4 CAS Registry Number NIST Chemistry WebBook
536-59-4 CAS Registry Number ChemIDplus
Citations
Last Modified
23 October 2015