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Substance Name: 1-(4-Aminobenzyl)-4-methyl-dtpa
RN: 132979-67-0
InChIKey: DJOOTICPUOKBRV-GDNMUNFISA-N

Molecular Formula

  • C22-H32-N4-O10.4Cl-H

Molecular Weight

  • 658.356
 
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Names and Synonyms

Name of Substance

  • 1-(4-Aminobenzyl)-4-methyl-dtpa

Synonyms

  • 1-(p-Aminobenzyl)-4-methyl-dtpa
  • 1-Abm-dtpa

Systematic Name

  • Glycine, N-(3-(4-aminophenyl)-2-(bis(carboxymethyl)amino)propyl)-N-(2-(bis(carboxymethyl)amino)propyl)-, tetrahydrochloride, (R*,S*)-(+-)-

Registry Numbers

CAS Registry Number

  • 132979-67-0

System Generated Number

  • 0132979670

Molecular Formulas

Molecular Formula

  • C22-H32-N4-O10.4Cl-H

Molecular Formula Fragments

  • C22-H32-N4-O10
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H32N4O10.4ClH/c1-14(25(10-19(29)30)11-20(31)32)7-24(9-18(27)28)8-17(6-15-2-4-16(23)5-3-15)26(12-21(33)34)13-22(35)36;;;;/h2-5,14,17H,6-13,23H2,1H3,(H,27,28)(H,29,30)(H,31,32)(H,33,34)(H,35,36);4*1H/t14-,17+;;;;/m0..../s1

InChIKey

DJOOTICPUOKBRV-GDNMUNFISA-N

Smiles

C(O)(C[N@@](C[C@H](C)N(CC(=O)O)CC(=O)O)C[C@@H](Cc1ccc(cc1)N)N(CC(=O)O)CC(=O)O)=O.Cl.Cl.Cl.Cl