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Substance Name: 1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-2,4-bis(1-aziridinyl)-2,4,6,6-tetramorpholino-, trans-
RN: 19591-93-6
InChIKey: UPCKTKGCNDPHOE-VSJLXWSYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H40-N9-O4-P3

Molecular Weight

  • 563.517
 
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Names and Synonyms

Synonym

  • BRN 6495167

Systematic Name

  • 1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-2,4-bis(1-aziridinyl)-2,4,6,6-tetramorpholino-, trans-

Registry Numbers

CAS Registry Number

  • 19591-93-6

System Generated Number

  • 0019591936

Structure Descriptors

InChI

1S/C20H40N9O4P3/c1-2-24(1)34(26-5-13-30-14-6-26)21-35(25-3-4-25,27-7-15-31-16-8-27)23-36(22-34,28-9-17-32-18-10-28)29-11-19-33-20-12-29/h1-20H2/t34-,35-/m1/s1

InChIKey

UPCKTKGCNDPHOE-VSJLXWSYSA-N

Smiles

N=1[P@@](=N[P@@](=NP1(N1CCOCC1)N1CCOCC1)(N1CCOCC1)N1CC1)(N1CCOCC1)N1CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1341, 1986.