CUCURBITACIN J

Structure

2D structure of CUCURBITACIN J
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 270061

Names and identifiers

Name

CUCURBITACIN J

Also reported as

CUCURBITACIN K

IUPAC name

(8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-17-((2R)-2,5,6-trihydroxy-6-methyl-3-oxoheptan-2-yl)-7,8,9,10,12,13,14,15,16,17-decahydro-3H-cyclopenta[a]phenanthrene-3,11(4H)-dione

SMILES

CC1(C2=CCC3C4(CC(C(C4(CC(=O)C3(C2C=C(C1=O)O)C)C)C(C)(C(=O)CC(C(C)(C)O)O)O)O)C)C

General information

Molecular formula

C30H44O8

Molecular weight

532.67 g/mol

Monoisotopic mass

532.3036 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Bryonia dioica Jacq. root -
Gmelin, R. (1964). The bitter principles of Bryonia dioica roots. isolation of cucurbitacins l, j, and k and of tetrahydrocucurbitacin. 1. a new natural cucurbitenin. Arzneim-Forsch, 14, 1021-1025
Bryonia dioica Jacq. root -
Tessier, A.M., Bouquet, A., Paris, R.R. (1975). Some toxic african Euphorbiaceae. Plant Med Phytother, 9, 238