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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-8-(hydroxymethyl)-8a-methoxy-5-methyl-1-propionyl-, carbamate (ester)
RN: 4055-19-0
InChIKey: UDEPOUWGBNLWFW-OTAFFUAVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H22-N4-O6

Molecular Weight

  • 390.3938
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 4055-19-0

System Generated Number

  • 0004055190

Structure Descriptors

InChI

1S/C18H22N4O6/c1-4-10(23)22-9-5-21-13-11(15(25)12(19)7(2)14(13)24)8(6-28-17(20)26)18(21,27-3)16(9)22/h8-9,16H,4-6,19H2,1-3H3,(H2,20,26)/t8-,9+,16+,18-,22?/m1/s1

InChIKey

UDEPOUWGBNLWFW-OTAFFUAVSA-N

Smiles

CCC(=O)N1[C@H]2CN3C4=C([C@@H](COC(=O)N)[C@@]3(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 18750ug/kg (18.75mg/kg)   Journal of Antibiotics, Series A. Vol. 20, Pg. 72, 1967.