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Substance Name: 7-Pentyloxy-7-demethoxymitomycin A
RN: 56981-77-2
InChIKey: UYUGLTZMKNFUGY-PTTPRXRQSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N3-O6

Molecular Weight

  • 405.4483
 
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Names and Synonyms

Results Name

  • 7-Pentyloxy-7-demethoxymitomycin A

Synonyms

  • 7-Pentyloxy-7-demethoxymitomycin A
  • 9-(Hydroxymethyl)-9a-methoxy-6-methyl-7-pentyloxymitosane carbamate

Systematic Name

  • Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-8-(hydroxymethyl)-8a-methoxy-5-methyl-6-pentyloxy-, carbamate

Registry Numbers

CAS Registry Number

  • 56981-77-2

System Generated Number

  • 0056981772

Structure Descriptors

InChI

1S/C20H27N3O6/c1-4-5-6-7-28-17-10(2)15(24)14-13(16(17)25)11(9-29-19(21)26)20(27-3)18-12(22-18)8-23(14)20/h11-12,18,22H,4-9H2,1-3H3,(H2,21,26)/t11-,12+,18+,20-/m1/s1

InChIKey

UYUGLTZMKNFUGY-PTTPRXRQSA-N

Smiles

CCCCCOC1=C(C)C(=O)C2=C([C@@H](COC(=O)N)[C@@]3(OC)[C@H]4N[C@H]4CN23)C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 10500ug/kg (10.5mg/kg)   Journal of Antibiotics. Vol. 33, Pg. 804, 1980.