CHEBI:81694 - 5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid

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ChEBI Name 5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid
ChEBI ID CHEBI:81694
Definition A dicarboxylic acid that is 5,5',6,6'-tetrahydroxy[biphenyl]-3,3'dicarboxylic acid in which one of the hydroxy groups that is meta to a carboxy group has been converted into the corresponding methyl ether.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H12O8
Net Charge 0
Average Mass 320.252
Monoisotopic Mass 320.05322
InChI InChI=1S/C15H12O8/c1-23-11-5-7(15(21)22)3-9(13(11)18)8-2-6(14(19)20)4-10(16)12(8)17/h2-5,16-18H,1H3,(H,19,20)(H,21,22)
InChIKey IOAGJFSRYOGIAF-UHFFFAOYSA-N
SMILES C1(C2=C(C(=CC(=C2)C(O)=O)O)O)=C(C(=CC(=C1)C(=O)O)OC)O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid (CHEBI:81694) is a aromatic ether (CHEBI:35618)
5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid (CHEBI:81694) is a carboxybiphenyl (CHEBI:141493)
5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid (CHEBI:81694) is a catechols (CHEBI:33566)
5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid (CHEBI:81694) is a dicarboxylic acid (CHEBI:35692)
5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid (CHEBI:81694) is a hydroxybiphenyls (CHEBI:24681)
5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid (CHEBI:81694) is conjugate acid of 5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylate (CHEBI:141402)
Incoming 5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylate (CHEBI:141402) is conjugate base of 5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid (CHEBI:81694)
IUPAC Name
5,6,6'-trihydroxy-5'-methoxy[biphenyl]-3,3'-dicarboxylic acid
Synonyms Sources
2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl KEGG COMPOUND
OH-DDVA ChEBI
Manual Xref Database
C18348 KEGG COMPOUND
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Registry Number Type Source
31158069 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
10347082 PubMed citation Europe PMC
16151081 PubMed citation Europe PMC
25217011 PubMed citation Europe PMC
28247503 PubMed citation Europe PMC
9501423 PubMed citation Europe PMC
9647824 PubMed citation Europe PMC
Last Modified
28 April 2020