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Quercetin 3-sophoroside

Quercetin 3-sophoroside structure

Quercetin 3-sophoroside 

structure
  • CAS No:

    7215-44-3

  • Formula:

    C27H30O17

  • Chemical Name:

    Quercetin 3-sophoroside

  • Synonyms:

    4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-3-[(2-O-β-D-glucopyranosyl-D-glucopyranosyl)oxy]-5,7-dihydroxy-;Flavone,3,3′,4′,5,7-pentahydroxy-,3-(2-O-β-D-glucopyranosyl-D-glucopyranoside);Flavone,3,3′,4′,5,7-pentahydroxy-,3-sophoroside;2-(3,4-Dihydroxyphenyl)-3-[(2-O-β-D-glucopyranosyl-D-glucopyranosyl)oxy]-5,7-dihydroxy-4H-1-benzopyran-4-one;Quercetin 3-sophoroside;Quercetin 3-O-β-D-sophoroside

Quercetin 3-sophoroside Basic Attributes

626.52

626.52

Characteristics

286

-1.2

1.89±0.1 g/cm3(Predicted)

202-203 °C

Computed Properties

Molecular Weight:626.5
XLogP3:-1.2
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:7
Exact Mass:626.14829948
Monoisotopic Mass:626.14829948
Topological Polar Surface Area:286
Heavy Atom Count:44
Complexity:1040
Defined Atom Stereocenter Count:9
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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