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Substance Name: Benzo(1,2-b:4,3-b')dipyrrole-2-carboxylic acid, 1,2,3,6,7,8-hexahydro-8-(bromomethyl)-2-methyl-1-oxo-4-((1-oxododecyl)oxy)-6-((5,6,7-trimethoxy-1H-indol-2-yl)carbonyl)-, methyl ester
RN: 129953-25-9
InChIKey: NURHDIOMNKFJIC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C38-H48-Br-N3-O9

Molecular Weight

  • 770.7132
 
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Names and Synonyms

  • Benzo(1,2-b:4,3-b')dipyrrole-2-carboxylic acid, 1,2,3,6,7,8-hexahydro-8-(bromomethyl)-2-methyl-1-oxo-4-((1-oxododecyl)oxy)-6-((5,6,7-trimethoxy-1H-indol-2-yl)carbonyl)-, methyl ester

Registry Numbers

CAS Registry Number

  • 129953-25-9

System Generated Number

  • 0129953259

Structure Descriptors

InChI

1S/C38H48BrN3O9/c1-7-8-9-10-11-12-13-14-15-16-28(43)51-26-19-25-29(30-32(26)41-38(2,35(30)44)37(46)50-6)23(20-39)21-42(25)36(45)24-17-22-18-27(47-3)33(48-4)34(49-5)31(22)40-24/h17-19,23,40-41H,7-16,20-21H2,1-6H3

InChIKey

NURHDIOMNKFJIC-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCC(=O)Oc1cc2c(c3c1NC(C3=O)(C)C(=O)OC)C(CN2C(=O)c4cc5cc(c(c(c5[nH]4)OC)OC)OC)CBr

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 500ug/kg (0.5mg/kg)   United States Patent Document. Vol. #5008271,