CHEBI:8043 - Phaseolic acid

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ChEBI Name Phaseolic acid
ChEBI ID CHEBI:8043
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C13H12O8
Net Charge 0
Average Mass 296.230
Monoisotopic Mass 296.05322
InChI InChI=1S/C13H12O8/c14-8-3-1-7(5-9(8)15)2-4-12(18)21-10(13(19)20)6-11(16)17/h1-5,10,14-15H,6H2,(H,16,17)(H,19,20)/b4-2+/t10-/m0/s1
InChIKey PMKQSEYPLQIEAY-YWNRKNDBSA-N
SMILES OC(=O)C[C@H](OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O
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 Phaseolic acid (CHEBI:8043) is a hydroxycinnamic acid (CHEBI:24689)
Synonym Source
Phaseolic acid KEGG COMPOUND
Manual Xrefs Databases
C00002765 KNApSAcK
C10483 KEGG COMPOUND
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Registry Number Type Source
53755-04-7 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014