OntologieschebiclassesCHEBI:90909   
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deoxyviolaceinic acid
http://purl.obolibrary.org/obo/CHEBI_90909

A pyrrolecarboxylic acid that is pyrrole-2-carboxylic acid which is substituted at position 3 by a 3-hydroxyindol-3-yl group at at position 5 by an indol-3-yl group.

Also appears inslmgo
Exact Synonyms
3-(2-hydroxy-1H-indol-3-yl)-5-(1H-indol-3-yl)-1H-pyrrole-2-carboxylic acid
class Information
charge

0

formula

C21H15N3O3

has_dbxref
has_obo_namespace

chebi_ontology

inchi

InChI=1S/C21H15N3O3/c25-20-18(12-6-2-4-8-16(12)24-20)13-9-17(23-19(13)21(26)27)14-10-22-15-7-3-1-5-11(14)15/h1-10,22-25H,(H,26,27)

inchikey

YNGCGCMGWQFYIK-UHFFFAOYSA-N

in_subset

3_STAR

mass

357.363

monoisotopicmass

357.11134

smiles

OC=1NC=2C(C1C=3C=C(NC3C(=O)O)C=4C=5C(NC4)=CC=CC5)=CC=CC2

class Relations