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Substance Name: Licoricesaponin G2
RN: 118441-84-2
UNII: 3TOQ2I088A
InChIKey: WBQVRPYEEYUEBQ-OJVDLISWSA-N

Molecular Formula

  • C42-H62-O17

Molecular Weight

  • 838.9348
 
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Names and Synonyms

Name of Substance

  • Licoricesaponin G2

Synonyms

  • 24-Hydroxyglycyrrhizin
  • beta-D-Glucopyranosiduronic acid, (3beta,4beta,20beta)-20-carboxy-23-hydroxy-11-oxo-30-norolean-12-en-3-yl 2-o-beta-D-glucopyranuronosyl-
  • Licorice-saponin G2
  • Licoricesaponin G2
  • Saponin G2, from licorice
  • UNII-3TOQ2I088A

Registry Numbers

CAS Registry Number

  • 118441-84-2

FDA UNII

  • 3TOQ2I088A

System Generated Number

  • 0118441842

Structure Descriptors

InChI

1S/C42H62O17/c1-37-11-12-38(2,36(54)55)16-19(37)18-15-20(44)31-39(3)9-8-22(40(4,17-43)21(39)7-10-42(31,6)41(18,5)14-13-37)56-35-30(26(48)25(47)29(58-35)33(52)53)59-34-27(49)23(45)24(46)28(57-34)32(50)51/h15,19,21-31,34-35,43,45-49H,7-14,16-17H2,1-6H3,(H,50,51)(H,52,53)(H,54,55)/t19-,21+,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35+,37+,38-,39-,40+,41+,42+/m0/s1

InChIKey

WBQVRPYEEYUEBQ-OJVDLISWSA-N

Smiles

C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H]([C@]([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O)O)O)C)(C)C(=O)O