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Substance Name: Ginsenoside Rb3
RN: 68406-26-8
InChIKey: SQRRROLAYTTYKS-NGAUNBLRSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C53-H90-O22

Molecular Weight

  • 1093.2988
 
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Names and Synonyms

Name of Substance

  • Ginsenoside RB3

Synonym

  • Ginsenoside RB3

Systematic Name

  • alpha-D-Glucopyranoside, (3-beta,12-beta)-3-((2-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-12-hydroxydammar-24-en-20-yl 6-O-beta-D-xylopyranosyl-

Registry Numbers

CAS Registry Number

  • 68406-26-8

System Generated Number

  • 0068406268

Structure Descriptors

InChI

1S/C54H92O22/c1-9-24(2)11-10-15-54(8,76-48-44(68)40(64)38(62)30(73-48)23-70-46-42(66)35(59)27(58)22-69-46)25-12-17-53(7)34(25)26(57)19-32-51(5)16-14-33(50(3,4)31(51)13-18-52(32,53)6)74-49-45(41(65)37(61)29(21-56)72-49)75-47-43(67)39(63)36(60)28(20-55)71-47/h11,25-49,55-68H,9-10,12-23H2,1-8H3/b24-11+/t25-,26+,27+,28+,29+,30+,31-,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,42+,43+,44+,45+,46-,47+,48-,49?,51-,52+,53+,54-/m0/s1

InChIKey

SQRRROLAYTTYKS-NGAUNBLRSA-N

Smiles

CC\C(=C\CC[C@](C)(O[C@@H]1O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]3CC[C@]4(C)[C@@H]3[C@H](O)C[C@@H]5[C@@]6(C)CC[C@H](O[C@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O[C@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)C(C)(C)[C@@H]6CC[C@@]45C)\C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 637mg/kg (637mg/kg)   French Demande Patent Document. Vol. #2430234,