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Substance Name: 1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-6,6-bis((2-ethoxy-2-oxoethyl)amino)-2,2,4,4-tetrakis(1-aziridinyl)-
RN: 5917-30-6
InChIKey: DWJSCTJHQQPMJK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H32-N9-O4-P3

Molecular Weight

  • 507.41
 
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Names and Synonyms

Synonyms

  • 5-20-01-00125 (Beilstein Handbook Reference)
  • BRN 1360859

Systematic Name

  • 1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-6,6-bis((2-ethoxy-2-oxoethyl)amino)-2,2,4,4-tetrakis(1-aziridinyl)-

Registry Numbers

CAS Registry Number

  • 5917-30-6

System Generated Number

  • 0005917306

Structure Descriptors

InChI

1S/C16H32N9O4P3/c1-3-28-15(26)13-17-30(18-14-16(27)29-4-2)19-31(22-5-6-22,23-7-8-23)21-32(20-30,24-9-10-24)25-11-12-25/h17-18H,3-14H2,1-2H3

InChIKey

DWJSCTJHQQPMJK-UHFFFAOYSA-N

Smiles

N=1P(=NP(=NP1(NCC(=O)OCC)NCC(=O)OCC)(N1CC1)N1CC1)(N1CC1)N1CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 170mg/kg (170mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1341, 1986.