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Substance Name: Saikosaponin B2
RN: 58316-41-9
InChIKey: WRYJYFCCMSVEPQ-ORAXXRKOSA-N

Molecular Formula

  • C42-H68-O13

Molecular Weight

  • 780.9862
 

Classification Codes

  • Analgesics
  • Analgesics, Non-Narcotic
  • Anti-Infective Agents
  • Anti-Inflammatory Agents
  • Anti-Inflammatory Agents, Non-Steroidal
  • Antineoplastic Agents
  • Antineoplastic Agents, Phytogenic
  • Antirheumatic Agents
  • Antiviral Agents
  • Immunologic Factors
  • Immunosuppressive Agents
  • Peripheral Nervous System Agents
  • Sensory System Agents
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Names and Synonyms

Name of Substance

  • Saikosaponin B2

Synonym

  • Saikosaponin B2

Registry Numbers

CAS Registry Number

  • 58316-41-9

System Generated Number

  • 0058316419

Structure Descriptors

InChI

1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3/t21-,24-,25-,26-,27-,28+,29+,30-,31+,32-,33-,34+,35+,36+,38+,39+,40-,41-,42-/m1/s1

InChIKey

WRYJYFCCMSVEPQ-ORAXXRKOSA-N

Smiles

C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@H]([C@]2(C)CO)CC[C@@]4([C@@H]3C=CC5=C6CC(CC[C@@]6([C@@H](C[C@]54C)O)CO)(C)C)C)C)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O