CHEBI:192831 - (E,E)-piperate

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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 (E,E)-piperate
ChEBI ID CHEBI:192831
ChEBI ASCII Name (E,E)-piperate
Definition Major species at pH 7.3
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C12H9O4
Net Charge -1
Average Mass 217.201
Monoisotopic Mass 217.05063
InChI InChI=1S/C12H10O4/c13-12(14)4-2-1-3-9-5-6-10-11(7-9)16-8-15-10/h1-7H,8H2,(H,13,14)/p-1/b3-1+,4-2+
InChIKey RHBGITBPARBDPH-ZPUQHVIOSA-M
SMILES C=1C2=C(C=CC1/C=C/C=C/C(=O)[O-])OCO2
ChEBI Ontology
Outgoing (E,E)-piperate (CHEBI:192831) is a carboxylic acid anion (CHEBI:29067)
(E,E)-piperate (CHEBI:192831) is conjugate base of (E,E)-piperic acid (CHEBI:37316)
Incoming (E,E)-piperic acid (CHEBI:37316) is conjugate acid of (E,E)-piperate (CHEBI:192831)
Synonym Source
(E,E)-piperate UniProt
Citation Waiting for Citations Type Source
33435446 PubMed citation SUBMITTER