PELARGONIDIN-3-SOPHOROSIDE

Structure

2D structure of PELARGONIDIN-3-SOPHOROSIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 44256623

Names and identifiers

Name

PELARGONIDIN-3-SOPHOROSIDE

IUPAC name

3-(((2S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2S,3R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium

SMILES

C1=CC(=CC=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O[C@H]4C(C([C@@H](C(O4)CO)O)O)O[C@H]5[C@@H](C([C@@H](C(O5)CO)O)O)O)O

General information

Molecular formula

C27H31O15+

Molecular weight

595.53 g/mol

Monoisotopic mass

595.1657 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
Yes

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

Plants with the compound

Plant Plant part Amount Reference
Papaver rhoeas L. subsp. rhoeas flower -
Hashem, F.M., Afifi, M.S., Saad, H.A. (1980). Investigation of anthocyanin content of Papaver rhoeas L. growing in egypt. Egypt J Pharm Sci, 21(1/2), 33-41