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Substance Name: ZnDTPA
RN: 65229-17-6
UNII: 828I5G7VJ6
InChIKey: UVJDUBUJJFBKLD-UHFFFAOYSA-L

Classification Code

  • Mutation Data

Molecular Formula

  • C14-H18-N3-O10-Zn.3H

Molecular Weight

  • 459.7446
 
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Names and Synonyms

Results Name

  • ZnDTPA

Name of Substance

  • Pentetate zinc

Synonyms

  • Diethylenetriaminepentaacetic acid, zinc salt
  • UNII-828I5G7VJ6
  • Zinc, (((carboxymethylimino)bis(ethylenenitrilo))tetraacetato)-
  • Zn-DTPA
  • ZnDTPA

Systematic Names

  • Zincate(3-), (N,N-bis(2-(((carboxy-kappaO)methyl)(carboxymethyl)amino-kappaN)ethyl)glycinato(5-)-kappaN,kappaO)-, trihydrogen
  • Zincate(3-), (N,N-bis(2-(bis(carboxymethyl)amino)ethyl)glycinato(5-))-, trihydrogen

Registry Numbers

CAS Registry Number

  • 65229-17-6

FDA UNII

  • 828I5G7VJ6

Other Registry Numbers

  • 12328-93-7
  • 7044-98-6

System Generated Number

  • 0065229176

Molecular Formulas

Molecular Formula

  • C14-H18-N3-O10-Zn.3H

Molecular Formula Fragments

  • C14-H18-N3-O10-Zn
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C14H23N3O10.Zn/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);/q;+2/p-2

InChIKey

UVJDUBUJJFBKLD-UHFFFAOYSA-L

Smiles

[H+].[H+].[H+].C1CN2(CC(=O)[O-][Zn+2]2345N1(CCN3(CC(=O)[O-]4)CC(=O)[O-])CC(=O)[O-]5)CC(=O)[O-]