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Substance Name: Colchicine, N-deacetyl-N-(p-nitrobenzoyl)-
RN: 76129-13-0
InChIKey: CRXFDHISRJTSDH-FQEVSTJZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H26-N2-O8

Molecular Weight

  • 506.5084
 
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Names and Synonyms

Synonyms

  • Benzamide, 4-nitro-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo(a)heptalen-7-yl)-
  • BRN 5323103
  • N-Deacetyl-N-(p-nitrobenzoyl)colchicine
  • NSC 309696

Systematic Name

  • Colchicine, N-deacetyl-N-(p-nitrobenzoyl)-

Registry Numbers

CAS Registry Number

  • 76129-13-0

System Generated Number

  • 0076129130

Structure Descriptors

InChI

1S/C27H26N2O8/c1-34-22-12-10-18-19(14-21(22)30)20(28-27(31)15-5-8-17(9-6-15)29(32)33)11-7-16-13-23(35-2)25(36-3)26(37-4)24(16)18/h5-6,8-10,12-14,20H,7,11H2,1-4H3,(H,28,31)/t20-/m0/s1

InChIKey

CRXFDHISRJTSDH-FQEVSTJZSA-N

Smiles

COC1=CC=C2C(=CC1=O)[C@H](CCc3cc(OC)c(OC)c(OC)c23)NC(=O)c4ccc(cc4)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 19mg/kg (19mg/kg)   Journal of Medicinal Chemistry. Vol. 24, Pg. 636, 1981.