Iron sodium DTPA

CAS Registry Number®

12389-75-2

CAS Name

Iron sodium DTPA

Molecular Formula

C14H18FeN3O10.H.Na

Cite this Page

Iron sodium DTPA.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=12389-75-2 (retrieved 2024-10-07) (CAS RN: 12389-75-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H23N3O10.Fe.Na/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;+3;+1/p-4

InChIKey

InChIKey=UEHRTZASQAWUOJ-UHFFFAOYSA-J

SMILES

C(C([O-])=O)[N]12[Fe+3]3456([N](CC[N]3(CC(=O)[O-]4)CC(=O)[O-]5)(CC1)CC(=O)[O-]6)[O-]C(=O)C2.[H+].[Na+]

Canonical SMILES

[H+].[Na+].O=C([O-])C[N]12CC(=O)[O-][Fe+3]34562[O-]C(=O)C[N]6(CC(=O)[O-]3)CC[N]5(CC(=O)[O-]4)CC1

Other Names for this Substance

  • Ferrate(2-), [rel-[N(R)]-N-[2-[bis[(carboxy-κO)methyl]amino-κN]ethyl]-N-[2-[(S)-[(carboxy-κO)methyl](carboxymethyl)amino-κN]ethyl]glycinato(5-)-κN,κO]-, sodium hydrogen (1:1:1), (PB-7-13-12564)-
  • Ferrate(2-), [N-[2-[bis[(carboxy-κO)methyl]amino-κN]ethyl]-N-[2-[[(carboxy-κO)methyl](carboxymethyl)amino-κN]ethyl]glycinato(5-)-κN,κO]-, sodium hydrogen, [PB-7-13-12564-(R*,S*)]-
  • Ferrate(2-), [rel-[N(R)]-N-[2-[bis[(carboxy-κO)methyl]amino-κN]ethyl]-N-[2-[(S)-[(carboxy-κO)methyl](carboxymethyl)amino-κN]ethyl]glycinato(5-)-κN,κO]-, sodium hydrogen, (PB-7-13-12564)-
  • Glycine, N,N-bis[2-[bis(carboxymethyl)amino]ethyl]-, iron complex
  • Ferrate(2-), [N,N-bis[2-[bis(carboxymethyl)amino]ethyl]glycinato(5-)]-, sodium hydrogen, [PB-7-13-12564-(R*,S*)]-

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