Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H16N3O6S2.Na |
Molecular Weight | 445.445 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[H][C@]12SCC(COC(C)=O)=C(N1C(=O)[C@H]2NC(=O)CSC3=CC=NC=C3)C([O-])=O
InChI
InChIKey=VGEOUKPOQQEQSX-OALZAMAHSA-M
InChI=1S/C17H17N3O6S2.Na/c1-9(21)26-6-10-7-28-16-13(15(23)20(16)14(10)17(24)25)19-12(22)8-27-11-2-4-18-5-3-11;/h2-5,13,16H,6-8H2,1H3,(H,19,22)(H,24,25);/q;+1/p-1/t13-,16-;/m1./s1
Molecular Formula | C17H16N3O6S2 |
Molecular Weight | 422.455 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
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 14:59:14 UTC 2023
by
admin
on
Fri Dec 15 14:59:14 UTC 2023
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Record UNII |
431LFF7I7J
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Record Status |
Validated (UNII)
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Record Version |
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-
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NCI_THESAURUS |
C357
Created by
admin on Fri Dec 15 14:59:14 UTC 2023 , Edited by admin on Fri Dec 15 14:59:14 UTC 2023
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CFR |
21 CFR 526.365
Created by
admin on Fri Dec 15 14:59:14 UTC 2023 , Edited by admin on Fri Dec 15 14:59:14 UTC 2023
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Code System | Code | Type | Description | ||
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1102500
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23675312
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100000088056
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179171
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431LFF7I7J
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C47440
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42562
Created by
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DTXSID7045574
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CHEMBL1599
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246-194-2
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m3253
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admin on Fri Dec 15 14:59:14 UTC 2023 , Edited by admin on Fri Dec 15 14:59:14 UTC 2023
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3545
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431LFF7I7J
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SUB01103MIG
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24356-60-3
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DBSALT000264
Created by
admin on Fri Dec 15 14:59:14 UTC 2023 , Edited by admin on Fri Dec 15 14:59:14 UTC 2023
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Related Record | Type | Details | ||
---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
---|---|---|---|---|
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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Related Record | Type | Details | ||
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ACTIVE MOIETY |