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Substance Name: Cimiracemoside M
RN: 473554-77-7
UNII: A3XBG3EN6B
InChIKey: MRJOSYQMJVDQDS-WONLXFFKSA-N

Molecular Formula

  • C39-H60-O11

Molecular Weight

  • 704.892
 
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Names and Synonyms

Name of Substance

  • Cimiracemoside M

Synonyms

  • 4',23-o-Diacetylshengmanol-3-o-beta-D-xylopyranoside
  • 9,19-Cyclolanostan-16-one, 23-(acetyloxy)-3-((4-O-acetyl-beta-D-xylopyranosyl)oxy)-24,25-epoxy-15-hydroxy-, (3beta,15alpha,23R,24S)-
  • Cimiracemoside M
  • Cimiracemoside M, (-)-
  • UNII-A3XBG3EN6B

Registry Numbers

CAS Registry Number

  • 473554-77-7

FDA UNII

  • A3XBG3EN6B

System Generated Number

  • 0473554777

Structure Descriptors

InChI

InChI=1S/C39H60O11/c1-19(16-22(47-20(2)40)32-35(6,7)50-32)27-29(43)31(45)37(9)25-11-10-24-34(4,5)26(12-13-38(24)18-39(25,38)15-14-36(27,37)8)49-33-30(44)28(42)23(17-46-33)48-21(3)41/h19,22-28,30-33,42,44-45H,10-18H2,1-9H3/t19-,22-,23-,24+,25+,26+,27+,28+,30-,31+,32+,33+,36-,37-,38-,39+/m1/s1

InChIKey

MRJOSYQMJVDQDS-WONLXFFKSA-N

Smiles

C[C@H](C[C@@H](OC(=O)C)[C@@H]1OC1(C)C)[C@H]2C(=O)[C@H](O)[C@@]3(C)[C@@H]4CC[C@H]5C(C)(C)[C@H](CC[C@@]56C[C@@]46CC[C@]23C)O[C@@H]7OC[C@@H](OC(=O)C)[C@H](O)[C@H]7O