Secondary Metabolites Search

TEUCROSIDE

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Structure

2D structure of TEUCROSIDE
2D structure
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3D model

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

Names and identifiers

Name

TEUCROSIDE

IUPAC name

4-(((2S,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-(((2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3-hydroxyphenethyl (E)-3-(3,4-dihydroxyphenyl)acrylate

SMILES

C1(=CC=C(C(=C1)O)O)\C(=C(\C(=O)OCCC2=CC=C(C(=C2)O)O[C@H]3[C@@H]([C@@H]([C@H]([C@H](C)O3)O[C@@H]5[C@H]([C@@H]([C@@H]([C@H](CO[C@H]4[C@@H]([C@@H]([C@H]([C@H](C)O4)O)O)O)O5)O)O)O)O)O)[H])[H]

General information

Molecular formula

C35H46O19

Molecular weight

770.73 g/mol

Monoisotopic mass

770.2633 Da

Classification

Pathway:
Shikimates and Phenylpropanoids
Superclass:
Phenylethanoids (C6-C2)
Class:
Cinnamic acids and derivatives
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Teucrium chamaedrys L. subsp. chamaedrys - -
Williamson, E. M. and Evans, F. J., Potter's New Cyclopaedia of Botanical Drugs and Preparations, Revised Ed., Saffron Walden, the C. W. Daniel Co., Ltd., Essex UK, 362 pp, 1988, reprint 1989.