ECHINATINE

Structure

2D structure of ECHINATINE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 12310804

Names and identifiers

Name

ECHINATINE

IUPAC name

((1S,7aR)-1-hydroxy-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl (2S,3S)-2,3-dihydroxy-2-isopropylbutanoate

SMILES

C[C@@H]([C@@](C(C)C)(C(=O)OCC1=CCN2[C@H]1[C@H](CC2)O)O)O

General information

Molecular formula

C15H25NO5

Molecular weight

299.37 g/mol

Monoisotopic mass

299.1733 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Eupatorium cannabinum L. subsp. cannabinum - -
Hendriks, H., Balraadjsing, W., Huizing, H.J., Bruins, A.P. (1987). Investigation into the presence of pyrrolizidine alkaloids in Eupatorium cannabinum by means of positive and negative ion chemical ionization gc-ms. Planta Med, 53(5), 456-461 doi:10.1055/s-2006-962772
Eupatorium cannabinum L. subsp. cannabinum aerial parts -
No reference
Eupatorium cannabinum L. subsp. cannabinum aerial parts -
Pedersen, E. (1975). Echinatine and supinine: pyrrolizidine alkaloids from Eupatorium cannabinum. Phytochemistry, 14, 2086-2087 doi:10.1016/0031-9422(75)83136-0
Heliotropium europaeum L. - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Symphytum officinale L. root -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.