QUINIC ACID,3-O-GALLOYL

Structure

2D structure of QUINIC ACID,3-O-GALLOYL
2D structure
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3D model

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

Names and identifiers

Name

QUINIC ACID,3-O-GALLOYL

IUPAC name

(3R,5R)-1,3,4-trihydroxy-5-((3,4,5-trihydroxybenzoyl)oxy)cyclohexane-1-carboxylic acid

SMILES

C1[C@H](C([C@@H](CC1(C(=O)O)O)OC(C2=CC(=C(C(=C2)O)O)O)=O)O)O

General information

Molecular formula

C14H16O10

Molecular weight

344.27 g/mol

Monoisotopic mass

344.0743 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Euphorbia helioscopia L. subsp. helioscopia aerial parts -
Ahn, B.T., Lee, S.H., Ro, J.S., Lee, K.S. (1995). A chemotaxonomic study on Euphorbiaceae in Korea. Nat Prod Sci, 1(1), 86-98