CHALCOMORACIN

Structure

2D structure of CHALCOMORACIN
2D structure
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3D model

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

Names and identifiers

Name

CHALCOMORACIN

IUPAC name

(2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)cyclohexyl)((1'R,2'R,3'R)-2,2'',4,6''-tetrahydroxy-4''-(6-hydroxyoctahydrobenzofuran-2-yl)-5'-methyl-[1,1':3',1''-tercyclohexan]-4'-en-2'-yl)methanone

SMILES

CC1=C[C@@H]([C@@H]([C@H](C1)C2CCC(CC2O)O)C(=O)C3CCC(C(C3O)CC=C(C)C)O)C4C(CC(CC4O)C5CC6CCC(CC6O5)O)O

General information

Molecular formula

C39H62O9

Molecular weight

674.92 g/mol

Monoisotopic mass

674.4394 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Morus alba L. root -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.