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Substance Name: Asparogoside C
RN: 60267-23-4
InChIKey: ZJCKMLSMXPLTKX-GMUIGVSZSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C39-H64-O13

Molecular Weight

  • 740.9216
 
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Names and Synonyms

Synonym

  • beta-D-Glucopyranoside, (3-beta,5-beta,25S)-spirostan-3-yl 3-O-beta-D-glucopyranosyl-

Systematic Name

  • Asparogoside C

Registry Numbers

CAS Registry Number

  • 60267-23-4

System Generated Number

  • 0060267234

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)48-36-33(46)34(30(43)27(16-41)50-36)51-35-32(45)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?/m0/s1

InChIKey

ZJCKMLSMXPLTKX-GMUIGVSZSA-N

Smiles

C[C@H]1CCC2([C@H]([C@H]3[C@@H](O2)CC4[C@@]3(CCC5C4CCC6[C@@]5(CCC(C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)C)C)C)OC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 20mg/kg (20mg/kg)   Pharmaceutical Chemistry Journal Vol. 11, Pg. 749, 1977.