Registration Dossier
Registration Dossier
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EC number: 235-627-0 | CAS number: 12389-75-2
Reference substances
- IUPAC name:
- Iron(3+) ion sodium 5-[bis(carboxylatomethyl)amino]-3-{[bis(carboxylatomethyl)amino]methoxy}pentanoate
Inventory
- EC number:
- 235-627-0
- EC name:
- Sodium hydrogen [N,N-bis[2-[bis(carboxymethyl)amino]ethyl]glycinato(5-)]ferrate(2-)
- CAS number:
- 12389-75-2
- CAS number:
- 12389-75-2
Synonyms
- Names:
- Ferrate(2-), [N,N-bis[2-[bis(carboxymethyl) amino]ethyl]glycinato(5-)]-, sodium hydrogen, (PB-7-13-12564)-
- Ferrate(2-), [N,N-bis[2-[bis(carboxymethyl)amino]ethyl]glycinato(5-)]-, sodium hydrogen, (PB-7-13-12
- Ferrate(2-), [rel-[N(R)]-N-[2-[bis[(carboxy-.kappa.O)methyl]amino-.kappa.N]ethyl]-N-[2-[(S)-[(carboxy-.kappa.O)methyl](carboxymethyl)amino-.kappa.N]ethyl]glycinato(5-)-.kappa.N,.kappa.O]-, sodium hydrogen, (PB-7-13-12564)-
- diethylenetriaminepentaacetic acid ferric-sodium complex
- iron(3+) ion sodium 2-\\{[2-(\\{2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)ethyl](carboxymethyl)amino}acetate]
- sodium hydrogen ferric diethylenetriaminepentaacetate
- sodium hydrogen ferric dtpa
- sodium; 2-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl-[2-[carboxymethyl-(2-oxido-2-oxoethyl)amino]ethyl]amino]acetate; iron(+3) cation
- Identifier:
- IUPAC name
- iron(3+) ion sodium 2-{[2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)ethyl](carboxymethyl)amino}acetate
- Identifier:
- IUPAC name
- iron(3+) sodium [{2-[{2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino]ethyl}(carboxymethyl)amino]acetate
- Identifier:
- other: Molecular formula
- C14H18FeN3O10.H.Na
- Identifier:
- other: Molecular formula
- C14H18FeN3O10Na
- Identifier:
- other: InChl
- InChI=1/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
- Identifier:
- other: SMILES notation
- [Fe+3].[Na+].OC(=O)CN(CCN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O)CC([O-])=O
- Identifier:
- other: SMILES notation
- [Na+].[Fe+3].OC(=O)CN(CCN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O)CC([O-])=O
Molecular and structural information
- Molecular formula:
- C14-H18-Fe-N3-O10.H.Na
- Molecular weight:
- 468.15
- SMILES notation:
- [Fe+3].[Na+].[O-]C(=O)CN(CC([O-])=O)CCN(CCN(CC(=O)O)CC([O-])=O)CC([O-])=O
synonym: C([N@@](CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])C[N@@](CC(O)=O)CC(=O)[O-].[Fe+3].[Na+] - InChl:
- 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
- Structural formula:
Related substances
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