6-O-ISOBUTYRYL-TETRAHYDROHELENALIN

Structure

2D structure of 6-O-ISOBUTYRYL-TETRAHYDROHELENALIN
2D structure
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3D model

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

Names and identifiers

Name

6-O-ISOBUTYRYL-TETRAHYDROHELENALIN

IUPAC name

(3R,3aR,4S,4aR,7aS,8R,9aR)-3,4a,8-trimethyl-2,5-dioxododecahydroazuleno[6,5-b]furan-4-yl isobutyrate

SMILES

C[C@@H]1C[C@@H]3[C@H]([C@@H]([C@]2([C@H]1CCC2=O)C)OC(C(C)C)=O)C(C)C(=O)O3

General information

Molecular formula

C19H28O5

Molecular weight

336.43 g/mol

Monoisotopic mass

336.1937 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Arnica montana L. subsp. montana flower -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.