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Substance Name: Colchicine, N-deacetyl-N-formyl-10-thio-
RN: 2731-23-9
InChIKey: QWMGUEXZTDFFTR-HNNXBMFYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N-O5-S

Molecular Weight

  • 401.4807
 
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Names and Synonyms

Synonyms

  • 4-14-00-00955 (Beilstein Handbook Reference)
  • BRN 2786590
  • N-(Formyldeacetyl)thiocolchicine
  • N-Deacetyl-N-formyl-10-thiocolchicine
  • NSC 373031

Systematic Name

  • Colchicine, N-deacetyl-N-formyl-10-thio-

Registry Numbers

CAS Registry Number

  • 2731-23-9

System Generated Number

  • 0002731239

Structure Descriptors

InChI

1S/C21H23NO5S/c1-25-17-9-12-5-7-15(22-11-23)14-10-16(24)18(28-4)8-6-13(14)19(12)21(27-3)20(17)26-2/h6,8-11,15H,5,7H2,1-4H3,(H,22,23)/t15-/m0/s1

InChIKey

QWMGUEXZTDFFTR-HNNXBMFYSA-N

Smiles

COc1cc2CC[C@H](NC=O)C3=CC(=O)C(=CC=C3c2c(OC)c1OC)SC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 58200ug/kg (58.2mg/kg)   Journal of Medicinal Chemistry. Vol. 28, Pg. 1204, 1985.