CHEBI:143587 - methyl erucate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name methyl erucate
ChEBI ID CHEBI:143587
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C23H44O2
Net Charge 0
Average Mass 352.595
Monoisotopic Mass 352.334
InChI InChI=1S/C23H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h10-11H,3-9,12-22H2,1-2H3/b11-10-
InChIKey ZYNDJIBBPLNPOW-KHPPLWFESA-N
SMILES O=C(OC)CCCCCCCCCCC/C=C\CCCCCCCC
Metabolite of Species Details
Olea europaea (NCBI:txid4146) Found in fruit (BTO:0000486). of strain Olea europaea L. See: MetaboLights Study
ChEBI Ontology
Outgoing methyl erucate (CHEBI:143587) is a fatty acid methyl ester (CHEBI:4986)
IUPAC Name
methyl (Z)-docos-13-enoate