Calcobutrol Sodium Salt
Product Specifications
CAS Number
2447549-29-1
Hazard Statement
Causes skin irritation.
Smiles
O=C(O[Na])CN1CCN(CC(O[Na])=O)CCN(CC(O[Na])=O)CCN([C@@H]([C@@H](CO)O)CO)CC1
Molecular Formula
C18 H31 N4 Na3 O9
Molecular Weight
516.429
InChI
InChI=1S/C18H34N4O9.3Na/c23-12-14(15(25)13-24)22-7-5-20(10-17(28)29)3-1-19(9-16(26)27)2-4-21(6-8-22)11-18(30)31;;;/h14-15,23-25H,1-13H2,(H,26,27)(H,28,29)(H,30,31);;;/q;3*+1/p-3/t14-,15-;;;/m1.../s1
Additionnal Information
IUPAC name: [2-[4,7-bis(2-oxo-2-sodiooxyethyl)-10-[(2R,3S)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetyl]oxysodium
Shipping Conditions
Room Temperature
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