**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

indole-3-carboxylate

Properties Image MNX_ID MNXM4016 reference chebi:62448 formula C9H6NO2 global charge -1 mol weight 160.152 InChIKey KMAKOBLIOCQGJP-UHFFFAOYSA-M InChI InChI=1S/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12)/p-1 SMILES O=C([O-])c1c[nH]c2ccccc12 MNX internals InChI (mnx) InChI=1/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12) SMILES (mnx) [cH:1]1[cH:2][cH:4][c:8]2[c:6]([cH:3]1)[c:7]([C:9]([OH:11])=[O:12])[cH:5][nH:10]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 6 in models (compartimentalized) 1

Similar chemical compounds in external resources

Identifier	Description
metacyc.compound:CPD-13135 metacycM:CPD-13135 CHEBI:62448 chebi:62448 KMAKOBLIOCQGJP-UHFFFAOYSA-M	indole-3-carboxylate 1H-indole-3-carboxylate
kegg.compound:C19837 keggC:C19837 KMAKOBLIOCQGJP-UHFFFAOYSA-N	Indole-3-carboxylate Indole-3-carboxylic acid
seed.compound:cpd21079 seedM:cpd21079 KMAKOBLIOCQGJP-UHFFFAOYSA-M	Indole-3-carboxylate Indole-3-carboxylic acid indole-3-carboxylate
sabiork.compound:27318 sabiorkM:27318 KMAKOBLIOCQGJP-UHFFFAOYSA-M	Indole-3-carboxylic acid
hmdb:HMDB0003320 KMAKOBLIOCQGJP-UHFFFAOYSA-N	Indole-3-carboxylic acid 1H-Indole-3-carboxylate 1H-Indole-3-carboxylic acid 1H-indole-3-carboxylic acid 3-Carboxyindole 3-Indole carboxylic acid 3-Indolecarboxylate 3-Indolecarboxylic acid 3-Indoleformate 3-Indoleformic acid 3-Indolylcarboxylate 3-Indolylcarboxylic acid Indole - 3 carboxylate Indole - 3 carboxylic acid Indole-3-carboxylate Indole-3-carboxylicacid Indole-b-carboxylate Indole-b-carboxylic acid Indole-beta-carboxylate Indole-beta-carboxylic acid indole - 3 carboxylic acid
CHEBI:24809 chebi:24809 KMAKOBLIOCQGJP-UHFFFAOYSA-N	indole-3-carboxylic acid 1H-indole-3-carboxylic acid
hmdb:HMDB03320 chebi:49657 keggC:M_C19837 seedM:M_cpd21079	secondary/obsolete/fantasy identifier