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Substance Name: Berbamine
RN: 478-61-5
UNII: V5KM4XJ0WM
InChIKey: DFOCUWZXJBAUSQ-URLMMPGGSA-N

Molecular Formula

  • C37-H40-N2-O6

Molecular Weight

  • 608.731
 

Classification Codes

  • Agricultural Chemical
  • Analgesics
  • Analgesics, Non-Narcotic
  • Anti-Arrhythmia Agents
  • Anti-Inflammatory Agents
  • Anti-Inflammatory Agents, Non-Steroidal
  • Antihypertensive Agents
  • Antirheumatic Agents
  • Calcium Channel Blockers
  • Cardiovascular Agents
  • Drug / Therapeutic Agent
  • Experimental Pesticide
  • Membrane Transport Modulators
  • Natural Product
  • Peripheral Nervous System Agents
  • Sensory System Agents
  • Unspecified / Unclassified Pesticide
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Names and Synonyms

Name of Substance

  • Berbamine

Synonyms

  • (+)-Berbamine
  • 2-27-00-00891 (Beilstein Handbook Reference)
  • 6,6',7-Trimethoxy-2,2'-dimethylberbaman-12-ol
  • Berbenine
  • BRN 0078902
  • CCRIS 6538
  • d-Berbamine
  • EINECS 207-523-5
  • NSC 121842
  • UNII-V5KM4XJ0WM

Systematic Names

  • Berbaman-12-ol, 6,6',7-trimethoxy-2,2'-dimethyl- (9CI)
  • Berbamine

Registry Numbers

CAS Registry Number

  • 478-61-5

FDA UNII

  • V5KM4XJ0WM

System Generated Number

  • 0000478615

Structure Descriptors

InChI

1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-31-18-23(8-11-30(31)40)17-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29+/m0/s1

InChIKey

DFOCUWZXJBAUSQ-URLMMPGGSA-N

Smiles

COc1cc2CCN(C)[C@H]3Cc4ccc(Oc5cc(C[C@H]6N(C)CCc7cc(OC)c(OC)c(Oc1cc23)c67)ccc5O)cc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 24, Pg. 2413, 1976.
mouse LD50 intravenous 17430ug/kg (17.43mg/kg)   Zhongcaoyao. Chinese Traditional and Herbal Medicine. Vol. 14, Pg. 45, 1983.
mouse LD50 oral 1700mg/kg (1700mg/kg)   Zhongcaoyao. Chinese Traditional and Herbal Medicine. Vol. 14, Pg. 45, 1983.
rat LDLo intraperitoneal 500mg/kg (500mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 26, 1953.