Peonidin 3-O-β-D-glucoside
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Peonidin 3-O-β-D-glucoside
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CAS No:
68795-37-9
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Formula:
C22H23O11
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Chemical Name:
Peonidin 3-O-β-D-glucoside
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Synonyms:
1-Benzopyrylium,3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-;3-(β-D-Glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyrylium;Peonidin 3-β-D-glucoside;Peonidin 3-glucoside;Peonidin 3-O-glucoside;Peonidin 3-O-β-D-glucoside;114017-66-2;171570-18-6
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CAS No:
Description
Solid
Peonidin 3-O-beta-D-glucoside is an anthocyanin cation that is the 3-O-beta-D-glucoside of peonidin (methylcyanidin). It has a role as an antioxidant and a plant metabolite. It is an anthocyanin cation, a beta-D-glucoside and a monosaccharide derivative. It derives from a peonidin. It is a conjugate acid of a peonidin 3-O-beta-D-glucoside betaine.
Computed Properties
Molecular Weight:463.4
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:5
Exact Mass:463.12403655
Monoisotopic Mass:463.12403655
Topological Polar Surface Area:170
Heavy Atom Count:33
Formal Charge:1
Complexity:638
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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