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Substance Name: Gymnemic acid II
RN: 122144-48-3
UNII: CUN60G2ITS
InChIKey: IWLKKMZNFBKYCF-GAZXINLWSA-N

Molecular Formula

  • C43-H68-O14

Molecular Weight

  • 808.9962
 
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Names and Synonyms

Name of Substance

  • Gymnemic acid II

Synonyms

  • (+)-Gymnemic acid II
  • beta-D-Glucopyranosiduronic acid, (3beta,4alpha,16beta,21beta,22alpha)-28-(acetyloxy)-16,22,23-trihydroxy-21-((2S)-2-methyl-1-oxobutoxy)olean-12-en-3-yl
  • Gymnemic acid II
  • Gymnemic acid ii, (+)-
  • UNII-CUN60G2ITS

Registry Numbers

CAS Registry Number

  • 122144-48-3

FDA UNII

  • CUN60G2ITS

System Generated Number

  • 0122144483

Structure Descriptors

InChI

1S/C43H68O14/c1-10-21(2)36(53)57-34-33(50)43(20-54-22(3)45)24(17-38(34,4)5)23-11-12-26-39(6)15-14-28(55-37-31(49)29(47)30(48)32(56-37)35(51)52)40(7,19-44)25(39)13-16-41(26,8)42(23,9)18-27(43)46/h11,21,24-34,37,44,46-50H,10,12-20H2,1-9H3,(H,51,52)/t21-,24-,25+,26+,27-,28-,29-,30-,31+,32-,33-,34-,37+,39-,40-,41+,42+,43-/m0/s1

InChIKey

IWLKKMZNFBKYCF-GAZXINLWSA-N

Smiles

CC[C@H](C)C(=O)O[C@H]1[C@@H]([C@@]2([C@H](C[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)C)C)[C@@H]2CC1(C)C)C)O)COC(=O)C)O