LACTUCOPICRIN

Structure

2D structure of LACTUCOPICRIN
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 154496864

Names and identifiers

Name

LACTUCOPICRIN

IUPAC name

(3aR,4S,9aR,9bR)-9-(hydroxymethyl)-6-methyl-3-methylene-2,7-dioxo-2,3,3a,4,5,7,9a,9b-octahydroazuleno[4,5-b]furan-4-yl 2-(4-hydroxyphenyl)acetate

SMILES

OC1=CC=C(CC(O[C@H]2CC(C)=C3C(C=C(CO)[C@H]3[C@H]4OC(C([C@H]24)=C)=O)=O)=O)C=C1

General information

Molecular formula

C23H22O7

Molecular weight

410.42 g/mol

Monoisotopic mass

410.1366 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Cichorium intybus L. exudate -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Cichorium intybus L. fruit -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Cichorium intybus L. root -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Lactuca sativa L. subsp. serriola (L.) Galasso, Banfi, Bartolucci & Ardenghi - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Mycelis muralis (L.) Dumort. subsp. muralis exudate -
Schmitt, A. (1940). Bitter principles in the milky juice of Lactuca virosa. ix. the determination of lactucopicrin and lactucin in composites, especially in Lactuca virosa. Bot Arch, 40, 516-559