Gadofosveset trisodium monohydrateProduct ingredient for Gadofosveset trisodium

Name
Gadofosveset trisodium monohydrate
Drug Entry
Gadofosveset trisodium

Gadofosveset trisodium is an intravenous contrast agent used with magnetic resonance angiography(MRA), which is a non-invasive way of imaging blood vessels. The agent allows for the vascular system to be imaged more clearly by the MRA. In this way, gadofosveset trisodium is used to help diagnose certain disorders of the heart and blood vessels.

Accession Number
DBSALT001858
Structure
Synonyms
Gadofosveset trisodium
UNII
XM33Q67UVH
CAS Number
211570-55-7
Weight
Average: 975.88
Monoisotopic: 976.11312
Chemical Formula
C33H40GdN3Na3O15P
InChI Key
PIZALBORPSCYJU-QSQMUHTISA-H
InChI
InChI=1S/C33H44N3O14P.Gd.3Na.H2O/c37-28(38)18-34(15-16-35(19-29(39)40)20-30(41)42)17-26(36(21-31(43)44)22-32(45)46)23-49-51(47,48)50-27-11-13-33(14-12-27,24-7-3-1-4-8-24)25-9-5-2-6-10-25;;;;;/h1-10,26-27H,11-23H2,(H,37,38)(H,39,40)(H,41,42)(H,43,44)(H,45,46)(H,47,48);;;;;1H2/q;+3;3*+1;/p-6/t26-;;;;;/m1...../s1
IUPAC Name
SMILES
O.[Na+].[Na+].[Na+].[Gd+3].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)C[C@H](COP([O-])(=O)OC1CCC(CC1)(C1=CC=CC=C1)C1=CC=CC=C1)N(CC([O-])=O)CC([O-])=O
ChemSpider
139381
Predicted Properties
PropertyValueSource
Water Solubility0.169 mg/mLALOGPS
logP3.84ALOGPS
logS-3.8ALOGPS
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon