1-Benzopyrylium, 3,5-bis(β-D-glucopyranosyloxy)-2-[3-(β-D-glucopyranosyloxy)-4-hydroxyphenyl]-7-hydroxy-, chloride (1:1)
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![1-Benzopyrylium, 3,5-bis(β-D-glucopyranosyloxy)-2-[3-(β-D-glucopyranosyloxy)-4-hydroxyphenyl]-7-hydroxy-, chloride (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/03ddf24bd8cb4cb385272b9a168a494e.png "1-Benzopyrylium, 3,5-bis(β-D-glucopyranosyloxy)-2-[3-(β-D-glucopyranosyloxy)-4-hydroxyphenyl]-7-hydroxy-, chloride (1:1)")
1-Benzopyrylium, 3,5-bis(β-D-glucopyranosyloxy)-2-[3-(β-D-glucopyranosyloxy)-4-hydroxyphenyl]-7-hydroxy-, chloride (1:1)
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CAS No:
88110-66-1
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Formula:
C33H41O21.Cl
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Chemical Name:
1-Benzopyrylium, 3,5-bis(β-D-glucopyranosyloxy)-2-[3-(β-D-glucopyranosyloxy)-4-hydroxyphenyl]-7-hydroxy-, chloride (1:1)
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Synonyms:
1-Benzopyrylium,3,5-bis(β-D-glucopyranosyloxy)-2-[3-(β-D-glucopyranosyloxy)-4-hydroxyphenyl]-7-hydroxy-,chloride (1:1);1-Benzopyrylium,3,5-bis(β-D-glucopyranosyloxy)-2-[3-(β-D-glucopyranosyloxy)-4-hydroxyphenyl]-7-hydroxy-,chloride;Cyanidin 3,5,3′-triglucoside
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CAS No:
Description
Cyanidin 3,3',5-tri-O-glucoside is a 5-hydroxyanthocyanin O-beta-D-glucoside. It derives from a cyanidin cation.
1-Benzopyrylium, 3,5-bis(β-D-glucopyranosyloxy)-2-[3-(β-D-glucopyranosyloxy)-4-hydroxyphenyl]-7-hydroxy-, chloride (1:1) Basic Attributes
773.7 g/mol
773.21403331 g/mol
DTXSID10331610
Computed Properties
Molecular Weight:773.7
Hydrogen Bond Donor Count:14
Hydrogen Bond Acceptor Count:20
Rotatable Bond Count:10
Exact Mass:773.21403331
Monoisotopic Mass:773.21403331
Topological Polar Surface Area:340
Heavy Atom Count:54
Formal Charge:1
Complexity:1190
Defined Atom Stereocenter Count:15
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-, chloride (1:1)
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1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-[(2-O-β-D-glucopyranosyl-α-D-glucopyranosyl)oxy]-5,7-dihydroxy-, chloride (1:1) Formula
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1-Benzopyrylium, 3-[(O-6-deoxy-α-L-mannopyranosyl-(1→6)-O-[D-glucopyranosyl-(1→2)]-β-D-glucopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-, chloride Formula
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