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Substance Name: Astragaloside I
RN: 91739-00-3
UNII: 24CT26I88H
InChIKey: KXHCYYSIAXMSPA-OOCCOBHWSA-N

Molecular Formula

  • C45-H72-O16

Molecular Weight

  • 869.0478
 
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Names and Synonyms

Name of Substance

  • Astragaloside I

Synonyms

  • Astragaloside I
  • Astragaloside I (constituent of astragalus) [DSC]
  • Astrasieversianin IV
  • beta-D-Glucopyranoside, (3beta,6alpha,16beta,20R,24S)-3-((2,3-di-O-acetyl-beta-D-xylopyranosyl)oxy)-20,24-epoxy-16,25-dihydroxy-9,19-cyclolanostan-6-yl
  • UNII-24CT26I88H

Registry Numbers

CAS Registry Number

  • 91739-00-3

FDA UNII

  • 24CT26I88H

System Generated Number

  • 0091739003

Structure Descriptors

InChI

1S/C45H72O16/c1-21(47)56-33-24(50)19-55-38(34(33)57-22(2)48)60-28-11-13-45-20-44(45)15-14-41(7)35(43(9)12-10-29(61-43)40(5,6)54)23(49)17-42(41,8)27(44)16-25(36(45)39(28,3)4)58-37-32(53)31(52)30(51)26(18-46)59-37/h23-38,46,49-54H,10-20H2,1-9H3/t23-,24+,25-,26+,27-,28-,29-,30+,31-,32+,33-,34+,35-,36-,37+,38-,41+,42-,43+,44-,45+/m0/s1

InChIKey

KXHCYYSIAXMSPA-OOCCOBHWSA-N

Smiles

CC(=O)O[C@H]1[C@@H](CO[C@H]([C@@H]1OC(=O)C)O[C@H]2CC[C@]34C[C@]35CC[C@@]6([C@H]([C@H](C[C@]6([C@@H]5C[C@@H]([C@H]4C2(C)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C)O)[C@]8(CC[C@H](O8)C(C)(C)O)C)C)O