OntologieschebiclassesCHEBI:90900   
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violaceinate
http://purl.obolibrary.org/obo/CHEBI_90900

A monocarboxylic acid anion that is the conjugate base of violaceinic acid, resulting from the removal of the proton from the carboxy group. Major structure at pH 7.3.

Also appears inslmgo
Exact Synonyms
violaceinate
class Information
charge

-1

formula

C21H14N3O4

has_dbxref
has_obo_namespace

chebi_ontology

inchi

InChI=1S/C21H15N3O4/c25-10-5-6-15-12(7-10)14(9-22-15)17-8-13(19(23-17)21(27)28)18-11-3-1-2-4-16(11)24-20(18)26/h1-9,22-26H,(H,27,28)/p-1

inchikey

AVEFAUDTSHGJQO-UHFFFAOYSA-M

in_subset

3_STAR

mass

372.354

monoisotopicmass

372.09898

smiles

OC=1NC=2C(C1C=3C=C(NC3C(=O)[O-])C=4C=5C(NC4)=CC=C(O)C5)=CC=CC2

class Relations