INDOLE-3-CARBOXYLIC ACID

Structure

2D structure of INDOLE-3-CARBOXYLIC ACID
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 69867

Names and identifiers

Name

INDOLE-3-CARBOXYLIC ACID

IUPAC name

1H-indole-3-carboxylic acid

SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)O

General information

Molecular formula

C9H7NO2

Molecular weight

161.16 g/mol

Monoisotopic mass

161.0477 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Arabidopsis thaliana (L.) Heynh. leaf -
Nakabayashi, R., Kusano, M., Kobayashi, M., Tohge, T., Yonekura-sakakibara, K., Kogure, N., Yamazaki, M., Kitajima, M., Saito, K., Takayama, H. (2009). Metabolomics-oriented isolation and structure elucidation of 37 compounds including two anthocyanins from Arabidopsis thaliana Phytochemistry, 70(8), 1017-1029 doi:10.1016/j.phytochem.2009.03.021