CHEBI:58459 - pyrroloquinoline quinol(3−)

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ChEBI Name pyrroloquinoline quinol(3−) ChEBI ID CHEBI:58459 ChEBI ASCII Name pyrroloquinoline quinol(3-) Definition Trianionic form of pyrroloquinoline quinol arising from deprotonation of the three carboxy groups. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information ChemicalBook:CB5474606, ZINC000002390960 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C14H5N2O8 Net Charge -3 Average Mass 329.19810 Monoisotopic Mass 329.00624 InChI InChI=1S/C14H8N2O8/c17-10-4-2-6(14(23)24)15-8(4)7-3(12(19)20)1-5(13(21)22)16-9(7)11(10)18/h1-2,15,17-18H,(H,19,20)(H,21,22)(H,23,24)/p-3 InChIKey QZMUBZJJJKIXKV-UHFFFAOYSA-K SMILES Oc1c(O)c2nc(cc(C([O-])=O)c2c2[nH]c(cc12)C([O-])=O)C([O-])=O ChEBI Ontology Outgoing pyrroloquinoline quinol(3−) (CHEBI:58459) is a pyrroloquinoline (CHEBI:50918) pyrroloquinoline quinol(3−) (CHEBI:58459) is a tricarboxylic acid trianion (CHEBI:27092) pyrroloquinoline quinol(3−) (CHEBI:58459) is conjugate acid of pyrroloquinoline quinol(4−) (CHEBI:77660) pyrroloquinoline quinol(3−) (CHEBI:58459) is conjugate base of pyrroloquinoline quinol (CHEBI:18356) Incoming pyrroloquinoline quinol (CHEBI:18356) is conjugate acid of pyrroloquinoline quinol(3−) (CHEBI:58459) pyrroloquinoline quinol(4−) (CHEBI:77660) is conjugate base of pyrroloquinoline quinol(3−) (CHEBI:58459) IUPAC Name 4,5-dihydroxy-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate Synonym Source pyrroloquinoline quinol trianion ChEBI Registry Number Type Source 342620 Gmelin Registry Number Gmelin Last Modified 17 April 2014