SCANDOSIDE,6-O-ACETYL

Structure

2D structure of SCANDOSIDE,6-O-ACETYL
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 6324968

Names and identifiers

Name

SCANDOSIDE,6-O-ACETYL

IUPAC name

(1S,4aS,5R,7aS)-5-acetoxy-7-(hydroxymethyl)-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid

SMILES

C1=C([C@@H]2[C@H]([C@@H]1OC(C)=O)C(=CO[C@H]2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)O)CO

General information

Molecular formula

C18H24O12

Molecular weight

432.38 g/mol

Monoisotopic mass

432.1268 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Galium album Mill. - -
Chervenkova, K., Nikolovadamyanova, B. (2000). The elution pattern of iridoid glucosides from Galium species on c-18 reversed-phase high performance liquid chromatography. J Liq Chrom Rel Technol, 23(5), 741-753 doi:10.1081/jlc-100101486