CHEBI:50543 - cis-isoeugenol

ChEBI IDCHEBI:50543
ChEBI Namecis-isoeugenol
Stars
ASCII Namecis-isoeugenol
Last Modified2 December 2009
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC10H12O2
Net Charge0
Average Mass164.204
Monoisotopic Mass164.08373
SMILESC/C=C\c1ccc(O)c(OC)c1
InChIInChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3-
InChIKeyBJIOGJUNALELMI-ARJAWSKDSA-N
Wikipedia
Roles Classification
Biological Roles:
sensitiser  A chemical compound that causes a substantial proportion of exposed people or animals to develop an allergic reaction in normal tissue after repeated exposure to the compound.
allergen  A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
ChEBI Ontology
Outgoing Relation(s)
cis-isoeugenol (CHEBI:50543) is a isoeugenol (CHEBI:18224)
IUPAC Name 
2-methoxy-4-[(1Z)-prop-1-en-1-yl]phenol
Synonyms  Source
cis-2-Methoxy-4-propenylphenolChemIDplus
cis-4-PropenylguaiacolChemIDplus
iso-Eugenol 1NIST Chemistry WebBook
Isoeugenol cis-formChemIDplus
Isoeugenol (II)NIST Chemistry WebBook
(Z)-2-methoxy-4-propenylphenolNIST Chemistry WebBook
Manual XrefsDatabases
IsoeugenolWikipedia
Registry NumbersSources
Beilstein:1909603Beilstein
CAS:5912-86-7ChemIDplus
CAS:5912-86-7NIST Chemistry WebBook