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Substance Name: Asiaticoside
RN: 16830-15-2
UNII: PKO39VY215
InChIKey: WYQVAPGDARQUBT-FGWHUCSPSA-N

Classification Codes

  • Anti-Infective Agents
  • Drug / Therapeutic Agent
  • Natural Product
  • Tumor Data

Molecular Formula

  • C48-H78-O19

Molecular Weight

  • 959.1252
 
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Names and Synonyms

Name of Substance

  • Asiaticoside

Synonyms

  • (O-alpha-L-Rhamnopyranoxyl-(1-4)-O-beta-D-glucopyranosyl-(1-6)-O-beta-D-glucopyranosyl)-2alpha,3beta,23-trihydroxy-12-ursen-28-oat
  • 2alpha,3beta,23-Trihydroxy-urs-12-en-28-saeure(O-alpha-L-rhamnopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-6)-O-beta-D-glucopyranosyl)ester
  • 4-17-00-03627 (Beilstein Handbook Reference)
  • Asiaticosid
  • Asiaticoside
  • Ba 2742
  • Blastoestimulina
  • BRN 0078195
  • CCRIS 8995
  • Centelase
  • Dermatologico
  • EINECS 240-851-7
  • Emdecassol
  • Madecassol
  • NSC 166062
  • NSC 36002
  • O-6-Desoxy-alpha-L-mannopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-6)-O-beta-D-glucopyranosyl 2alpha,3beta,23-trihydroxy-12-ursen-28-at
  • UNII-PKO39VY215

Systematic Names

  • O-6-Deoxy-alpha-L-mannopyranosyl-(1.4)-O-beta-D-glucopyranosyl-(1.6)-beta-D-glucopyranosyl (2alpha,3beta,4alpha)-2,3,23-trihydroxyurs-12-en-28-oate
  • Urs-12-en-28-oic acid, 2,3,23-trihydroxy-, O-6-deoxy-alpha-L-mannopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-6)-beta-D-glucopyranosyl ester, (2alpha,3beta,4alpha)-
  • Urs-12-en-28-oic acid, 2-alpha,3-beta,23-trihydroxy-, O-6-deoxy-alpha-L-mannopyranosyl-(1-4)-o-beta-D-glucopyranosyl-(1-6)-o-beta-D-glucopyranosyl ester

Registry Numbers

CAS Registry Number

  • 16830-15-2

FDA UNII

  • PKO39VY215

Other Registry Number

  • 910246-26-3

System Generated Number

  • 0016830152

Structure Descriptors

InChI

1S/C48H78O19/c1-20-10-13-48(15-14-46(6)23(29(48)21(20)2)8-9-28-44(4)16-24(51)39(60)45(5,19-50)27(44)11-12-47(28,46)7)43(61)67-42-36(58)33(55)31(53)26(65-42)18-62-40-37(59)34(56)38(25(17-49)64-40)66-41-35(57)32(54)30(52)22(3)63-41/h8,20-22,24-42,49-60H,9-19H2,1-7H3/t20-,21+,22+,24-,25-,26-,27-,28-,29+,30+,31-,32-,33+,34-,35-,36-,37-,38-,39+,40-,41+,42+,44+,45+,46-,47-,48+/m1/s1

InChIKey

WYQVAPGDARQUBT-FGWHUCSPSA-N

Smiles

C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O