RETRONECINE,9-ANGELYL

Structure

2D structure of RETRONECINE,9-ANGELYL
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 638872

Names and identifiers

Name

RETRONECINE,9-ANGELYL

IUPAC name

((1R,7aR)-1-hydroxy-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl (Z)-2-methylbut-2-enoate

SMILES

C2CN1CC=C([C@@H]1[C@@H]2O)COC(\C(=C(/C)[H])C)=O

General information

Molecular formula

C13H19NO3

Molecular weight

237.30 g/mol

Monoisotopic mass

237.1365 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Echium vulgare L. subsp. vulgare aerial parts -
El-shazly, A., Sarg, T., Ateya, A., Aziz, A.A., El-dahmy, S., Witte, L., Wink, M. (1996). Pyrrolizidine alkaloids from Echium setosum and Echium vulgare. J Nat Prod, 59(3), 310-313 doi:10.1021/np9600661
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