Products 71991-88-3

CAS 71991-88-3 is the registry number for 1-Benzopyrylium,2-(3,4-dihydroxy-5-methoxyphenyl)-3-(b-D-glucopyranosyloxy)-5,7-dihydroxy-. Offered by: Chemat. Available pack sizes: 1mg, 5mg.

1-Benzopyrylium,2-(3,4-dihydroxy-5-methoxyphenyl)-3-(b-D-glucopyranosyloxy)-5,7-dihydroxy-
Chemat
  • size: 1mg, 5mg
  • Variants: 2
from 2349.20
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Structural formula: {0} (CAS {1})

Petunidin 3-O-beta-D-glucoside is an anthocyanin cation that is petunidin substituted at position 3 by a beta-D-glucosyl residue. It has a role as an antioxidant and a metabolite. It is a beta-D-glucoside, an anthocyanin cation and an aromatic ether. It is functionally related to a petunidin.

Source: ChEBI

Identity
Molecular formulaC22H23O12+
Molecular weight479.4 g/mol
IUPAC name(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
InChIKeyCCQDWIRWKWIUKK-QKYBYQKWSA-O
SMILESCOC1=CC(=CC(=C1O)O)C2=[O+]C3=CC(=CC(=C3C=C2O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Petunidin 3-glucoside, Petunidin-3-glucoside, Petunidin-3-O-glucoside, Petunidin 3-monoglucoside, anthocyanin Pt3G, Petunidin monoglucoside, Petunidin 3-O-glucoside, petunidin-3-O-beta-D-glucoside, Petunidin 3-O-beta-D-glucopyranoside, petunidin-3-monoglucoside
Related forms of this compound
(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol C22H23O12+
2-[2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol C22H23O12+