Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C33H38N3O14P.Gd.3Na.H2O |
Molecular Weight | 975.87 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
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)(C2=CC=CC=C2)C3=CC=CC=C3)N(CC([O-])=O)CC([O-])=O
InChI
InChIKey=PIZALBORPSCYJU-QSQMUHTISA-H
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
Molecular Formula | HO |
Molecular Weight | 17.0073 |
Charge | -1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C33H39N3O14P |
Molecular Weight | 732.6482 |
Charge | -5 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | Gd |
Molecular Weight | 157.25 |
Charge | 3 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:51:21 UTC 2023
by
admin
on
Fri Dec 15 15:51:21 UTC 2023
|
Record UNII |
XM33Q67UVH
|
Record Status |
Validated (UNII)
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Record Version |
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-
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EMA ASSESSMENT REPORTS |
ABLAVAR (WITHDRAWN: RADIO RESONANCE PERFUSION)
Created by
admin on Fri Dec 15 15:51:21 UTC 2023 , Edited by admin on Fri Dec 15 15:51:21 UTC 2023
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NCI_THESAURUS |
C62358
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admin on Fri Dec 15 15:51:21 UTC 2023 , Edited by admin on Fri Dec 15 15:51:21 UTC 2023
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XM33Q67UVH
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100000089561
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Gadofosveset
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XM33Q67UVH
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DB06705
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SS-17
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1364289
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CHEMBL1908843
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SUB21051
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158440
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C81057
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211570-55-7
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DTXSID501027793
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |