CHEBI:31119 - 3-Methylpyrrole-2,4-dicarboxylic acid

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ChEBI Name 3-Methylpyrrole-2,4-dicarboxylic acid
ChEBI ID CHEBI:31119
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C7H7NO4
Net Charge 0
Average Mass 169.135
Monoisotopic Mass 169.03751
InChI InChI=1S/C7H7NO4/c1-3-4(6(9)10)2-8-5(3)7(11)12/h2,8H,1H3,(H,9,10)(H,11,12)
InChIKey DVIKMLHVAWYDMS-UHFFFAOYSA-N
SMILES Cc1c(c[nH]c1C(O)=O)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 3-Methylpyrrole-2,4-dicarboxylic acid (CHEBI:31119) is a carboxylic acid (CHEBI:33575)
3-Methylpyrrole-2,4-dicarboxylic acid (CHEBI:31119) is a pyrroles (CHEBI:26455)
Synonym Source
3-Methylpyrrole-2,4-dicarboxylic acid KEGG COMPOUND
Manual Xref Database
C12477 KEGG COMPOUND
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Last Modified
28 July 2014