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(5,8-Bis((carboxy-kappaO)methyl)-11-(2-(methylamino)-2-(oxo-kappaO)ethyl)-3-(oxo-kappaO)-2,5,8,11-tetraazatridecan-13-oato(3-)-kappaN5,kappaN8,kappaN11,kappaO)dysprosium

HCID 72052
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
128470-17-7
Standard SMILES
CNC(=O)CN(CCN(CCN(CC(=O)[O-])CC(=O)NC)CC(=O)[O-])CC(=O)[O-].[Dy+3]
InChIKey
ABWHOEHSTSEVRD-UHFFFAOYSA-K
Molecular formula
C16H26DyN5O8
Average molar mass
578.91 g/mol
Monoisotopic mass
580.107319

Overview

a magnetic susceptibility-based MRI contrast agent; a diagnostic aid; RN given refers to anhydrous compound

Names & identifiers

Preferred name
(5,8-Bis((carboxy-kappaO)methyl)-11-(2-(methylamino)-2-(oxo-kappaO)ethyl)-3-(oxo-kappaO)-2,5,8,11-tetraazatridecan-13-oato(3-)-kappaN5,kappaN8,kappaN11,kappaO)dysprosium
IUPAC
2-[bis[2-[carboxylatomethyl-[2-(methylamino)-2-oxoethyl]amino]ethyl]amino]acetate;dysprosium(3+)

Names & synonyms

Sprodiamide128470-17-7DyDTPA-BMADy-DTPA-BMA0E6DA2DHBEDTXSID60155909esprodiamidasprodiamidumWIN-59080RefChem:906176DTXCID5078400dysprosium DTPA-bis(methylamide)
Show more names
dysprosium diethylenetriaminepentaacetic acid-bis(methylamide)(5,8-Bis((carboxy-kappaO)methyl)-11-(2-(methylamino)-2-(oxo-kappaO)ethyl)-3-(oxo-kappaO)-2,5,8,11-tetraazatridecan-13-oato(3-)-kappaN5,kappaN8,kappaN11,kappaO)dysprosium140224-06-21C1ZU7JLFXSprodiamide hydrateSprodiamide anhydrousS-0432-[bis[2-[carboxylatomethyl-[2-(methylamino)-2-oxoethyl]amino]ethyl]amino]acetate;dysprosium(3+)

Database identifiers

CAS
128470-17-7、167165-71-1
PubChem CID
72052
DTXSID
DTXSID60155909
UNII
0E6DA2DHBE

Properties

Computed structural properties

Topological polar surface area
188 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
11
Rotatable bonds
13
Heavy atoms
30
Formal charge
0
Complexity
527

Chemistry & industry

Pharmacology

MeSH Pharmacological ClassificationSubstances used to allow enhanced visualization of tissues.

Related reactions

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Compound notes

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