Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C18H31N4O9.Ca.H |
| Molecular Weight | 488.546 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H+].[Ca++].OC[C@@H](O)[C@@H](CO)N1CCN(CC([O-])=O)CCN(CC([O-])=O)CCN(CC([O-])=O)CC1
InChI
InChIKey=GCLKDXFGQNCFQW-CTHHTMFSSA-L
InChI=1S/C18H34N4O9.Ca/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;+2/p-2/t14-,15-;/m1./s1
Calcobutrol, is a new macrocyclic polyhydroxylated gadolinium chelate derivative which can be used as a contrast agent for Magnetic Resonance Imaging (MRI) and component of Gadavist. Gadavist is a gadolinium-based contrast agent indicated for intravenous use in diagnostic MRI in adults and children (2 years of age and older) to detect and visualize areas with disrupted blood brain barrier (BBB) and/or abnormal vascularity of the central nervous system
Approval Year
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7733
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300000036852
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C80920
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J1A8830GE7
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151878-23-8
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CHEMBL2111181
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76967066
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DTXSID00934356
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C45678
Created by
admin on Mon Mar 31 18:22:29 GMT 2025 , Edited by admin on Mon Mar 31 18:22:29 GMT 2025
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CONCEPT | Industrial Aid |
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
