BULGARSENINE

Structure

2D structure of BULGARSENINE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 6443225

Names and identifiers

Name

BULGARSENINE

IUPAC name

(6R,7R,10aS,10a1R,15aR,E)-7-hydroxy-4,6,7-trimethyl-6,7,10,10a,10a1,11,12,14,15,15a-decahydro-2H-[1,6]dioxacyclotridecino[2,3,4-gh]pyrrolizine-2,8(5H)-dione

SMILES

C[C@@H]1C/C(=C/C(=O)O[C@@H]2CCN3[C@@H]2[C@H](CC3)COC(=O)[C@]1(C)O)/C

General information

Molecular formula

C18H27NO5

Molecular weight

337.42 g/mol

Monoisotopic mass

337.1889 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Senecio ovatus (G.Gaertn., B.Mey. & Scherb.) Willd. subsp. alpestris (Gaudin) Herborg leaf -
Gottlieb, R. (1990). Gas chromatographic-mass spectrometric evaluation of the pyrrolizidine alkaloids. Dtsch Apoth Ztg, 130(6), 285-288