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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-butyryl-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)
RN: 4055-12-3
InChIKey: DCHJWLSTFSRMHO-JBTQJBKUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H24-N4-O6

Molecular Weight

  • 404.4206
 
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Names and Synonyms

Synonym

  • BRN 0864456

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-butyryl-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)

Registry Numbers

CAS Registry Number

  • 4055-12-3

System Generated Number

  • 0004055123

Structure Descriptors

InChI

1S/C19H24N4O6/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/h9-10,17H,4-7,20H2,1-3H3,(H2,21,27)/t9-,10+,17+,19?,23?/m1/s1

InChIKey

DCHJWLSTFSRMHO-JBTQJBKUSA-N

Smiles

CCCC(=O)N1[C@H]2CN3C4=C([C@@H](COC(=O)N)C3(OC)[C@@H]12)C(=O)C(=C(C)C4=O)N

Toxicity

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