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Substance Name: Corilagin
RN: 23094-69-1
UNII: 62LOS9TW6D
InChIKey: TUSDEZXZIZRFGC-VPIGZIKCSA-N

Note

  • Isolated from Geranii herba.

Molecular Formula

  • C27-H22-O18

Molecular Weight

  • 634.4528
 
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Names and Synonyms

Name of Substance

  • Corilagin

Synonyms

  • Corilagin
  • UNII-62LOS9TW6D

Systematic Name

  • beta-D-Glucopyranose, cyclic 3,6-(4,4',5,5',6,6'-hexahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) 1-(3,4,5-trihydroxybenzoate), (R)-

Registry Numbers

CAS Registry Number

  • 23094-69-1

FDA UNII

  • 62LOS9TW6D

System Generated Number

  • 0023094691

Structure Descriptors

InChI

1S/C27H22O18/c28-9-1-6(2-10(29)16(9)32)24(39)45-27-22(38)23-19(35)13(43-27)5-42-25(40)7-3-11(30)17(33)20(36)14(7)15-8(26(41)44-23)4-12(31)18(34)21(15)37/h1-4,13,19,22-23,27-38H,5H2/t13-,19-,22-,23+,27+/m0/s1

InChIKey

TUSDEZXZIZRFGC-VPIGZIKCSA-N

Smiles

c1c(cc(c(c1O)O)O)C(=O)O[C@@H]2[C@H]([C@H]3[C@H]([C@@H](O2)COC(=O)c4cc(c(c(c4-c5c(cc(c(c5O)O)O)C(=O)O3)O)O)O)O)O