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Substance Name: 1a-Acetylmitomycin C
RN: 1102-95-0
InChIKey: RLPARBOQTNGFMR-XEACYCJLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H20-N4-O6

Molecular Weight

  • 376.367
 
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Names and Synonyms

Name of Substance

  • 1a-Acetylmitomycin C

Synonyms

  • BRN 0590954
  • Mitomycin C, acetyl-

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 1102-95-0

System Generated Number

  • 0001102950

Structure Descriptors

InChI

1S/C17H20N4O6/c1-6-11(18)14(24)10-8(5-27-16(19)25)17(26-3)15-9(21(15)7(2)22)4-20(17)12(10)13(6)23/h8-9,15H,4-5,18H2,1-3H3,(H2,19,25)/t8-,9+,15+,17-,21?/m1/s1

InChIKey

RLPARBOQTNGFMR-XEACYCJLSA-N

Smiles

CO[C@@]12[C@H](COC(=O)N)C3=C(N1C[C@H]4[C@@H]2N4C(=O)C)C(=O)C(=C(N)C3=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18750ug/kg (18.75mg/kg)   Journal of Antibiotics, Series A. Vol. 20, Pg. 72, 1967.