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Substance Name: Batrachotoxinin-A N-methylanthranilate
RN: 97779-14-1
InChIKey: WRXNSZUMLDUSOO-OCXZKYLZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C32-H42-N2-O6

Molecular Weight

  • 550.692
 
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Names and Synonyms

Name of Substance

  • Batrachotoxinin-A N-methylanthranilate

Synonyms

  • Batrachotoxinin A 20-alpha-N-methylanthranilate
  • BTX-NMA

Systematic Name

  • Batrachotoxinin A, 20-(2-(methylamino)benzoate)

Registry Numbers

CAS Registry Number

  • 97779-14-1

System Generated Number

  • 0097779141

Structure Descriptors

InChI

1S/C32H42N2O6/c1-20(39-27(36)22-7-5-6-8-24(22)33-3)23-11-12-31-25-10-9-21-17-30(37)14-13-28(21,2)32(25,40-30)26(35)18-29(23,31)19-34(4)15-16-38-31/h5-8,10-11,20-21,26,33,35,37H,9,12-19H2,1-4H3/t20?,21-,26-,28+,29?,30+,31+,32?/m1/s1

InChIKey

WRXNSZUMLDUSOO-OCXZKYLZSA-N

Smiles

C1=2[C@@]3([C@@]4([C@@H](C[C@](O3)(O)CC4)CC2)C)[C@@H](C[C@@]23[C@@]1(CC=C2[C@@H](OC(c1c(cccc1)NC)=O)C)OCC[N@@](C3)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 15ug/kg (0.015mg/kg)   Journal of Neuroscience Methods. Vol. 13, Pg. 119, 1985.