Secondary metabolite: 1H-indole-3-carboxylic acid



1H-indole-3-carboxylic acid
Summary
Molecular formula: C9H7NO2
SMILES: OC(=O)c1c[nH]c2c1cccc2
InChI: InChI=1S/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12)
InChIKey: KMAKOBLIOCQGJP-UHFFFAOYSA-N
Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2[nH]ccc2c1

Scaffold Graph/Node level:
C1CCC2NCCC2C1

Scaffold Graph level:
C1CCC2CCCC2C1
Chemical classification
Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Indoles and derivatives
Sub class: Indolecarboxylic acids and derivatives
Synonymous chemical names:
1h-indole-3-carboxylic acid
External chemical identifiers:
CID_69867; CAS_771-50-6; CHEMSPIDER_63063; ZINC_ZINC000000158741; Molport_MolPort-000-142-458
Chemical structure download

Designed by R.P. Vivek-Ananth, M Karthikeyan and Ajaya Kumar Sahoo