2,4,6-TRIMETHYL-3-OXO-5-INDANACETIC-ACID

Structure

2D structure of 2,4,6-TRIMETHYL-3-OXO-5-INDANACETIC-ACID
2D structure
Drag to rotate, scroll to zoom
3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 5320784

Names and identifiers

Name

2,4,6-TRIMETHYL-3-OXO-5-INDANACETIC-ACID

IUPAC name

2-(2,4,6-trimethyl-3-oxo-2,3-dihydro-1H-inden-5-yl)acetic acid

SMILES

CC1CC2=CC(=C(C(=C2C1=O)C)CC(=O)O)C

General information

Molecular formula

C14H16O3

Molecular weight

232.28 g/mol

Monoisotopic mass

232.1099 Da

Classification

Pathway:
Superclass:
-
Class:
-
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Pteridium aquilinum (L.) Kuhn subsp. aquilinum - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.