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Substance Name: Tomaymycin
RN: 35050-55-6
InChIKey: UQVNRKBFAXNOGA-LWTNMJDUSA-N

Classification Codes

  • Anti-Bacterial Agents
  • Anti-Infective Agents
  • Antibiotics, Antineoplastic
  • Antineoplastic Agents
  • Drug / Therapeutic Agent
  • Mutation Data
  • Natural Product

Molecular Formula

  • C16-H20-N2-O4

Molecular Weight

  • 304.344
 
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Names and Synonyms

Name of Substance

  • Tomaymycin

Synonyms

  • NSC 177499
  • Tomaymycin

Systematic Names

  • 2-Ethylidene-1,2,3,10,11,11a-hexahydro-8-hydroxy- 7,11-dimethoxy-5H-pyrrolo(2,1-c)(1,4)benzodiazepin-5-one
  • 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 2-ethylidene-1,2,3,10,11,11a-hexahydro-8-hydroxy-7,11-dimethoxy-, (11R-(2E,11-alpha,11a-beta))-

Registry Numbers

CAS Registry Number

  • 35050-55-6

System Generated Number

  • 0035050556

Structure Descriptors

InChI

1S/C16H20N2O4/c1-4-9-5-12-15(22-3)17-11-7-13(19)14(21-2)6-10(11)16(20)18(12)8-9/h4,6-7,12,15,17,19H,5,8H2,1-3H3/b9-4+/t12-,15+/m0/s1

InChIKey

UQVNRKBFAXNOGA-LWTNMJDUSA-N

Smiles

C/C=C/1\C[C@H]2[C@H](Nc3cc(c(cc3C(=O)N2C1)OC)O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1mg/kg (1mg/kg)   Toxicology Letters. Vol. 18, Pg. 337, 1983.
mouse LD50 intravenous 3540ug/kg (3.54mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 5, Pg. 186, 1981.
mouse LD50 subcutaneous 7400ug/kg (7.4mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 5, Pg. 186, 1981.