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Substance Name: U 74500A
RN: 110101-65-0
UNII: IDW4RCM01L
InChIKey: BINFIZGKEZTZIO-ZRTOZFNYSA-N

Note

  • Potent inhibitor of iron-dependent lipid peroxidation; has excellent activity in in vivo models of experimental CNS trauma & ischemia; Cancer Lett 1992;64(1):61-6 uses 5,6-bis(diethylamino) cpd for U 74500A.

Molecular Formula

  • C39-H57-N5-O2.x-Cl-H

Molecular Weight

  • 664.373
 

Classification Codes

  • Anti-Ulcer Agents
  • Antioxidants
  • Gastrointestinal Agents
  • Immunologic Factors
  • Immunosuppressive Agents
  • Protective Agents
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Names and Synonyms

Name of Substance

  • U 74500A

Synonyms

  • 21-(4-(3,6-Bis(diethylamino)-2-pyridinyl)-1-piperazinyl)-16-methylpregna-1,4,9(11)triene-3,20-dione hcl
  • 21-(4-(5,6-Bis(diethylamino)-2-pyridinyl)-1-piperazinyl)-16-methylpregna-1,4,9(11)triene-3,20-dione hcl
  • U-74500A
  • U74500A
  • UNII-IDW4RCM01L

Systematic Name

  • Pregna-1,4,9(11)-triene-3,20-dione, 21-(4-(3,6-bis(diethylamino)-2-pyridinyl)-1-piperazinyl)-16-methyl-, hydrochloride, (16alpha)-

Registry Numbers

CAS Registry Number

  • 110101-65-0

FDA UNII

  • IDW4RCM01L

System Generated Number

  • 0110101650

Molecular Formulas

Molecular Formula

  • C39-H57-N5-O2.x-Cl-H

Molecular Formula Fragments

  • C39-H57-N5-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C39H57N5O2.ClH/c1-8-42(9-2)33-14-15-35(43(10-3)11-4)40-37(33)44-22-20-41(21-23-44)26-34(46)36-27(5)24-32-30-13-12-28-25-29(45)16-18-38(28,6)31(30)17-19-39(32,36)7;/h14-18,25,27,30,32,36H,8-13,19-24,26H2,1-7H3;1H/t27-,30-,32+,36-,38+,39+;/m1./s1

InChIKey

BINFIZGKEZTZIO-ZRTOZFNYSA-N

Smiles

c1cc(c(N2CCN(CC([C@@H]3[C@@]4(C)CC=C5[C@@]6(C(CC[C@@H]5[C@@H]4C[C@H]3C)=CC(=O)C=C6)C)=O)CC2)nc1N(CC)CC)N(CC)CC.Cl