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Substance Name: Quercetin 3-rutinoside-7-glucoside
RN: 30311-61-6
InChIKey: SPUFXPFDJYNCFD-YQJBXTIASA-N

Molecular Formula

  • C33-H40-O21

Molecular Weight

  • 772.658
 
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Names and Synonyms

Results Name

  • Quercetin 3-rutinoside-7-glucoside

Synonyms

  • Quercetin 3-O-rutinoside-7-O-glucoside
  • Quercetin 3-rhamnoglucoside 7-beta-glucoside
  • Quercetin 3-rutinoside-7-glucoside

Systematic Name

  • Flavone, 3,3',4',5,7-pentahydroxy-, 3-(6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside) 7-beta-D-glucopyranoside

Registry Numbers

CAS Registry Number

  • 30311-61-6

System Generated Number

  • 0030311616

Structure Descriptors

InChI

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

InChIKey

SPUFXPFDJYNCFD-YQJBXTIASA-N

Smiles

c1(c(oc2c(c1=O)c(cc(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)c1cc(c(cc1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O