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Substance Name: 4(G)-alpha-Glucopyranosyl-rutin
RN: 130603-71-3
InChIKey: PFPQMWRASYNLMZ-LGIMBNBCSA-N

Molecular Formula

  • C33-H40-O21

Molecular Weight

  • 772.658
 
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Names and Synonyms

Name of Substance

  • 4(G)-alpha-Glucopyranosyl-rutin

Synonyms

  • 3-((O-6-Deoxy-alpha-L-mannopyranosyl-(1-6)-O-(alpha-D-glucopyranosyl-(1-4))-beta-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
  • alpha G-Rutin
  • EC 424-170-4
  • Glu-rutin

Systematic Names

  • 3-(6-O-(6-Desoxy-alpha-L-mannopyranosyl-O-(alpha-D-glucopyranosyl)-(beta-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
  • 4H-1-Benzopyran-4-one, 3-((O-6-deoxy-alpha-L-mannopyranosyl-(1-6)-O-(alpha-D-glucopyranosyl-(1-4))-beta-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-

Registry Numbers

CAS Registry Number

  • 130603-71-3

System Generated Number

  • 0130603713

Structure Descriptors

InChI

1S/C33H40O21/c1-9-19(39)22(42)25(45)31(49-9)48-8-17-29(53-32-26(46)23(43)20(40)16(7-34)51-32)24(44)27(47)33(52-17)54-30-21(41)18-14(38)5-11(35)6-15(18)50-28(30)10-2-3-12(36)13(37)4-10/h2-6,9,16-17,19-20,22-27,29,31-40,42-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,22+,23-,24+,25+,26+,27+,29+,31+,32+,33-/m0/s1

InChIKey

PFPQMWRASYNLMZ-LGIMBNBCSA-N

Smiles

C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(Oc4cc(O)cc(O)c4C3=O)c5ccc(O)c(O)c5)[C@H](O)[C@@H](O)[C@@H]2O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H](O)[C@H]1O