CROCATONE

Structure

2D structure of CROCATONE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 177099

Names and identifiers

Name

CROCATONE

IUPAC name

1-(7-methoxybenzo[d][1,3]dioxol-5-yl)propan-1-one

SMILES

CCC(=O)C1=CC2=C(C(=C1)OC)OCO2

General information

Molecular formula

C11H12O4

Molecular weight

208.21 g/mol

Monoisotopic mass

208.0736 Da

Classification

Pathway:
-
Superclass:
-
Class:
-
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Siler montanum Crantz subsp. montanum rhizome -
Smitalova, Z., Budesinsky, M., Saman, D., Vasickova, S., Holub, M. (1984). Components of the extract from the underground parts of Laserpitium siler L. of slovenian origin, mainly sesquiterpenic lactones. Collect Czech Chem Commun, 49(4), 852-870 doi:10.1135/cccc19840852