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Substance Name: Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-amino-1-crotonyl-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)
RN: 16910-71-7
InChIKey: BUPQKPJZGHOJQW-BIHFKAJGSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-N4-O6

Molecular Weight

  • 402.4048
 
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Names and Synonyms

Synonym

  • BRN 0591812

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 16910-71-7

Other Registry Numbers

  • 19556-13-9
  • 21469-90-9

System Generated Number

  • 0016910717

Structure Descriptors

InChI

1S/C19H22N4O6/c1-4-5-11(24)23-10-6-22-14-12(16(26)13(20)8(2)15(14)25)9(7-29-18(21)27)19(22,28-3)17(10)23/h4-5,9-10,17H,6-7,20H2,1-3H3,(H2,21,27)/b5-4+/t9-,10+,17+,19-,23?/m1/s1

InChIKey

BUPQKPJZGHOJQW-BIHFKAJGSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 75mg/kg (75mg/kg)   Journal of Antibiotics, Series A. Vol. 20, Pg. 72, 1967.