DTPA-4-aminobutane-1,1-diphosphonate
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DTPA-4-aminobutane-1,1-diphosphonate
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CAS No:
133049-44-2
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Formula:
C18H31GdN4O15P2
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Chemical Name:
DTPA-4-aminobutane-1,1-diphosphonate
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Synonyms:
4-aminobutane-1,1-diphosphonate-Gd-DTPA;DTPA-4-aminobutane-1,1-diphosphonate;GdDTPA-BDP;2-[2-[bis(carboxylatomethyl)amino]ethyl-[2-[carboxylatomethyl-[2-(4,4-diphosphonatobutylamino)-2-oxoethyl]amino]ethyl]amino]acetate;gadolinium(3+);hydron;Gadoliante(5-), (9,12,15-tris(carboxymethyl)-1,1-dihydroxy-7-oxo-2-phosphono-6,9,12,15-tetraaza-1-phosphaheptadecan-17-oic acid 1 -oxidato-N9,N12,N15,O7,O9,O12,O15,O17)-, pentahydrogen
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CAS No:
Computed Properties
Molecular Weight:762.7
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:16
Exact Mass:763.05023
Monoisotopic Mass:763.05023
Topological Polar Surface Area:326
Heavy Atom Count:40
Complexity:870
Covalently-Bonded Unit Count:7
Compound Is Canonicalized:Yes
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DTPA-4-aminobutane-1,1-diphosphonate
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