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Substance Name: Deacylgymnemic acid
RN: 121686-42-8
InChIKey: NXUZSZLFZAMZLC-BNLARJOSSA-N

Note

  • From the leaves of Gymnema sylvestre.

Molecular Weight

  • 682.842
 
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Names and Synonyms

Name of Substance

  • Deacylgymnemic acid

Systematic Name

  • beta-D-Glucopyranosiduronic acid, (3beta,4alpha,16beta,21beta,22alpha)-16,21,22,23,28-pentahydroxyolean-12-en-3-yl

Registry Numbers

CAS Registry Number

  • 121686-42-8

System Generated Number

  • 0121686428

Structure Descriptors

InChI

1S/C36H58O12/c1-31(2)13-18-17-7-8-20-32(3)11-10-22(47-30-25(42)23(40)24(41)26(48-30)29(45)46)33(4,15-37)19(32)9-12-34(20,5)35(17,6)14-21(39)36(18,16-38)28(44)27(31)43/h7,18-28,30,37-44H,8-16H2,1-6H3,(H,45,46)/t18-,19?,20?,21-,22?,23+,24+,25-,26+,27-,28-,30-,32+,33?,34-,35-,36+/m1/s1

InChIKey

NXUZSZLFZAMZLC-BNLARJOSSA-N

Smiles

O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O)[C@@H]1CC[C@@]2([C@@H]3CC=C4[C@H]5CC([C@@H]([C@H]([C@@]5([C@@H](C[C@@]4([C@@]3(CC[C@@H]2[C@@]1(CO)C)C)C)O)CO)O)O)(C)C)C