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indole-3-carboxylate

Properties

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Occurences in reactions

MNX_ID

MNXM4016

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	1

formula

C₉H₆NO₂

charge

-1

mass

160.0404

reference

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-13135 metacycM:CPD-13135 CHEBI:62448 chebi:62448	indole-3-carboxylate 1H-indole-3-carboxylate
kegg.compound:C19837 keggC:C19837	Indole-3-carboxylate Indole-3-carboxylic acid
seed.compound:cpd21079 seedM:cpd21079	Indole-3-carboxylate Indole-3-carboxylic acid indole-3-carboxylate
sabiork.compound:27318 sabiorkM:27318	Indole-3-carboxylic acid
hmdb:HMDB0003320	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 - 3 carboxylic acid
CHEBI:24809 chebi:24809	indole-3-carboxylic acid 1H-indole-3-carboxylic acid
hmdb:HMDB03320 chebi:49657 keggC:M_C19837 seedM:M_cpd21079	secondary/obsolete/fantasy identifier