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Substance Name: Carbamic acid, (5,6,7,9-tetrahydro-10-(methylthio)-9-oxo-1,2,3-trimethoxybenzo(a)heptalen-7-yl)-, ethyl ester, (S)-
RN: 63620-51-9
InChIKey: SMEGTTUCKYOLLP-INIZCTEOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H27-N-O6-S

Molecular Weight

  • 445.5333
 
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Names and Synonyms

Synonyms

  • 4-14-00-00959 (Beilstein Handbook Reference)
  • BRN 3181473
  • N-(Ethoxycarbonyl)deacetylthiocolchicine
  • NSC 249278

Systematic Name

  • Carbamic acid, (5,6,7,9-tetrahydro-10-(methylthio)-9-oxo-1,2,3-trimethoxybenzo(a)heptalen-7-yl)-, ethyl ester, (S)-

Registry Numbers

CAS Registry Number

  • 63620-51-9

System Generated Number

  • 0063620519

Structure Descriptors

InChI

1S/C23H27NO6S/c1-6-30-23(26)24-16-9-7-13-11-18(27-2)21(28-3)22(29-4)20(13)14-8-10-19(31-5)17(25)12-15(14)16/h8,10-12,16H,6-7,9H2,1-5H3,(H,24,26)/t16-/m0/s1

InChIKey

SMEGTTUCKYOLLP-INIZCTEOSA-N

Smiles

CCOC(=O)N[C@H]1CCc2cc(OC)c(OC)c(OC)c2C3=CC=C(SC)C(=O)C=C13

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 29mg/kg (29mg/kg)   Journal of Medicinal Chemistry. Vol. 24, Pg. 636, 1981.