CHEBI:174146 - Dehydrochorismic acid

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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 Dehydrochorismic acid
ChEBI ID CHEBI:174146
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H8O6
Net Charge 0
Average Mass 224.168
Monoisotopic Mass 224.03209
InChI InChI=1S/C10H8O6/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11/h2-4,11H,1H2,(H,12,13)(H,14,15)
InChIKey LKNPFOZIOWXDQS-UHFFFAOYSA-N
SMILES O(C=1C=C(C=CC1O)C(O)=O)C(C(O)=O)=C
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Dehydrochorismic acid (CHEBI:174146) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name
3-(1-carboxyethenoxy)-4-hydroxybenzoic acid
Manual Xrefs Databases
8096552 ChemSpider
HMDB0036314 HMDB
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