THYMOL-ISO-BUTYRATE,8-9-EPOXY: 10-ISO-BUTYRYL-OXY

Structure

2D structure of THYMOL-ISO-BUTYRATE,8-9-EPOXY: 10-ISO-BUTYRYL-OXY
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 11472669

Names and identifiers

Name

THYMOL-ISO-BUTYRATE,8-9-EPOXY: 10-ISO-BUTYRYL-OXY

IUPAC name

(2-(2-(isobutyryloxy)-4-methylphenyl)oxiran-2-yl)methyl isobutyrate

SMILES

C1(=CC=C(C(=C1)OC(C(C)C)=O)C2(CO2)COC(C(C)C)=O)C

General information

Molecular formula

C18H24O5

Molecular weight

320.39 g/mol

Monoisotopic mass

320.1624 Da

Classification

Pathway:
Superclass:
-
Class:
-
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Pulicaria dysenterica (L.) Bernh. aerial parts -
Bohlmann, F., Zdero, C. (1981). Caryophyllene derivatives and a hydroxyisocomene from Pulicaria dysenterica. Phytochemistry, 20(11), 2529-2534 doi:10.1016/0031-9422(81)83087-7