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Substance Name: Uralsaponin Y
RN: 1616062-90-8
UNII: 2BU15C47BB
InChIKey: SSBMWWLCFVHYNK-XAAGFIOPSA-N

Molecular Formula

  • C48-H70-O20

Molecular Weight

  • 967.061
 
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Names and Synonyms

Name of Substance

  • Uralsaponin Y

Synonyms

  • 3beta-O-(alpha-Lrhamnopyranosyl-(1->2)-beta-D-glucuronopyranosyl-(1->2)-beta-dglucuronopyranosyl)glabrolide
  • beta-D-Glucopyranosiduronic acid, (3beta,20beta,22beta)-22,29-epoxy-11,29-dioxoolean-12-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1->2)-o-beta-D-glucopyranuronosyl-(1->2)-
  • UNII-2BU15C47BB
  • Uralsaponin Y

Registry Numbers

CAS Registry Number

  • 1616062-90-8

FDA UNII

  • 2BU15C47BB

System Generated Number

  • 1616062908

Structure Descriptors

InChI

1S/C48H70O20/c1-18-25(50)26(51)31(56)39(62-18)67-35-30(55)28(53)33(38(59)60)66-41(35)68-34-29(54)27(52)32(37(57)58)65-40(34)63-23-10-11-46(6)22(43(23,2)3)9-12-48(8)36(46)21(49)15-19-20-16-44(4)17-24(64-42(44)61)45(20,5)13-14-47(19,48)7/h15,18,20,22-36,39-41,50-56H,9-14,16-17H2,1-8H3,(H,57,58)(H,59,60)/t18-,20-,22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,32-,33-,34+,35+,36+,39-,40+,41-,44+,45+,46-,47+,48+/m0/s1

InChIKey

SSBMWWLCFVHYNK-XAAGFIOPSA-N

Smiles

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2O[C@@H]3[C@H]([C@@H]([C@H](O[C@H]3O[C@H]4CC[C@]5([C@H](C4(C)C)CC[C@@]6([C@@H]5C(=O)C=C7[C@]6(CC[C@@]8([C@H]7C[C@@]9(C[C@H]8OC9=O)C)C)C)C)C)C(=O)O)O)O)C(=O)O)O)O)O)O)O