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Substance Name: 7-Isopropoxy-7-demethoxymitomycin A
RN: 56981-61-4
InChIKey: VGGQUQHRSOYJSK-QJIICXBUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H23-N3-O6

Molecular Weight

  • 377.3947
 
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Names and Synonyms

Results Name

  • 7-Isopropoxy-7-demethoxymitomycin A

Synonyms

  • 7-Isopropoxy-7-demethoxymitomycin A
  • 9-(Hydroxymethyl)-7-isopropoxy-9a-methoxy-6-methylmitosane carbamate
  • BRN 5776967

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 56981-61-4

System Generated Number

  • 0056981614

Structure Descriptors

InChI

1S/C18H23N3O6/c1-7(2)27-15-8(3)13(22)12-11(14(15)23)9(6-26-17(19)24)18(25-4)16-10(20-16)5-21(12)18/h7,9-10,16,20H,5-6H2,1-4H3,(H2,19,24)/t9-,10+,16+,18-/m1/s1

InChIKey

VGGQUQHRSOYJSK-QJIICXBUSA-N

Smiles

CO[C@]12[C@H]3N[C@H]3CN1C4=C([C@H]2COC(=O)N)C(=O)C(=C(C)C4=O)OC(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 4500ug/kg (4.5mg/kg)   Journal of Antibiotics. Vol. 33, Pg. 804, 1980.