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Substance Name: Smilageninoside
RN: 138831-68-2
InChIKey: MMTWXUQMLQGAPC-ZKXXMABPSA-N

Note

  • Isolated from the rhizomes of Anemarrhena asphdeloides.

Molecular Weight

  • 740.922
 
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Names and Synonyms

Name of Substance

  • Smilageninoside

Synonym

  • Smilagenin 3-O-(beta-D-glucopyranosyl 1-2)-beta-D-mannopyranoside

Registry Numbers

CAS Registry Number

  • 138831-68-2

System Generated Number

  • 0138831682

Structure Descriptors

InChI

1S/C39H64O13/c1-18-7-12-39(47-17-18)19(2)28-25(52-39)14-24-22-6-5-20-13-21(8-10-37(20,3)23(22)9-11-38(24,28)4)48-36-34(32(45)30(43)27(16-41)50-36)51-35-33(46)31(44)29(42)26(15-40)49-35/h18-36,40-46H,5-17H2,1-4H3/t18-,19+,20?,21?,22?,23?,24?,25+,26-,27-,28+,29-,30-,31+,32+,33-,34+,35+,36-,37+,38+,39?/m1/s1

InChIKey

MMTWXUQMLQGAPC-ZKXXMABPSA-N

Smiles

O([C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@H](O2)CO)[C@@H](O)[C@H](O)[C@H](O1)CO)[C@@H]1CC[C@@]2([C@@H]3CC[C@@]4([C@@H]5[C@H](C[C@@H]4[C@@H]3CC[C@@H]2C1)O[C@@]1([C@H]5C)OC[C@@H](CC1)C)C)C