CHEBI:221072 - APE Vf

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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 APE Vf
ChEBI ID CHEBI:221072
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H24O3
Net Charge 0
Average Mass 336.431
Monoisotopic Mass 336.17254
InChI InChI=1S/C22H24O3/c1-18-16-20(17-19(2)22(18)24)14-12-10-8-6-4-5-7-9-11-13-15-21(23)25-3/h4-17,24H,1-3H3/b6-4+,7-5+,10-8+,11-9+,14-12+,15-13+
InChIKey FJZUHVAAANRIMP-MOVKVLISSA-N
SMILES O=C(OC)/C=C/C=C/C=C/C=C/C=C/C=C/C1=CC(=C(O)C(=C1)C)C
Metabolite of Species Details
Aliivibrio fischeri ES114 (NCBI:txid312309) See: PubMed
ChEBI Ontology
Outgoing APE Vf (CHEBI:221072) is a hydroxytoluene (CHEBI:24751)
IUPAC Name
methyl (2E,4E,6E,8E,10E,12E)-13-(4-hydroxy-3,5-dimethylphenyl)trideca-2,4,6,8,10,12-hexaenoate