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Quercetin 3-O-sophoroside

Quercetin 3-O-sophoroside structure

Quercetin 3-O-sophoroside 

structure
  • CAS No:

    18609-17-1

  • Formula:

    C27H30O17

  • Chemical Name:

    Quercetin 3-O-sophoroside

  • Synonyms:

    4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-;Flavone,3,3′,4′,5,7-pentahydroxy-,3-(2-O-β-D-glucopyranosyl-β-D-glucopyranoside);Flavone,3,3′,4′,5,7-pentahydroxy-,3-β-D-sophoroside;2-(3,4-Dihydroxyphenyl)-3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-4H-1-benzopyran-4-one;Quercetin 3-β-sophoroside;Q 6;Quercetin 3-O-sophoroside;Quercetin 3-β-D-sophoroside;Baimaside;Quercetin 3-O-(2-O-β-D-glucopyranosyl)-β-D-glucopyranoside;Quercetin-3-O-β-D-glucosyl-(2→1)-β-D-glucoside;Quercetin 3-O-β-D-glucopyranosyl(1→2)-β-D-glucopyranoside;31564-15-5

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside is a quercetin O-glucoside that is quercetin attached to a beta-D-sophorosyl residue at position 3 via a glycosidic linkage. It has a role as an antioxidant and a plant metabolite. It is a tetrahydroxyflavone and a sophoroside. It is a conjugate acid of a quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside(1-).

Quercetin 3-O-sophoroside Basic Attributes

626.51700

626.52

Characteristics

289.66000

-2.71470

1.89g/cm3

198-200 °C

1037.2ºC at 760mmHg

341.8ºC

1.785

0mmHg at 25°C

Drug Information

quercetin-3-O-sophoroside

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:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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