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Substance Name: Vitalboside A
RN: 3391-80-8
InChIKey: ZNFRITHWVZXJRK-SZUUDGAKSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C36-H58-O8

Molecular Weight

  • 618.846
 
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Names and Synonyms

Results Name

  • Vitalboside A

Synonyms

  • beta1-Fatsin
  • Hederoside A2
  • Oleanolic acid 3-O-glucoside
  • Vitalboside A

Systematic Name

  • Olean-12-en-28-oic acid, 3-beta-(beta-D-glucopyranosyloxy)-

Registry Numbers

CAS Registry Number

  • 3391-80-8

System Generated Number

  • 0003391808

Structure Descriptors

InChI

1S/C36H58O8/c1-31(2)14-16-36(30(41)42)17-15-34(6)20(21(36)18-31)8-9-24-33(5)12-11-25(32(3,4)23(33)10-13-35(24,34)7)44-29-28(40)27(39)26(38)22(19-37)43-29/h8,21-29,37-40H,9-19H2,1-7H3,(H,41,42)/t21-,22-,23?,24-,25+,26-,27+,28-,29+,33+,34-,35-,36+/m1/s1

InChIKey

ZNFRITHWVZXJRK-SZUUDGAKSA-N

Smiles

C1[C@@H](C(C)(C)[C@@H]2CC[C@@]3(C)[C@]4(C)CC[C@@]5(C(=O)O)CCC(C)(C)C[C@H]5C4=CC[C@H]3[C@@]2(C1)C)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3600mg/kg (3600mg/kg)   Indian Journal of Pharmacology. Vol. 15, Pg. 331, 1983.
rat LD50 oral 1500mg/kg (1500mg/kg)   Indian Journal of Pharmacology. Vol. 15, Pg. 331, 1983.