Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H21N6O5S.Na |
| Molecular Weight | 456.451 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)NC(N)=N)C3=CC=CC=C3)C(=O)N2[C@H]1C([O-])=O
InChI
InChIKey=MSWIMMZSNIYLNP-YWUHCJSESA-M
InChI=1S/C18H22N6O5S.Na/c1-18(2)11(15(27)28)24-13(26)10(14(24)30-18)21-12(25)9(8-6-4-3-5-7-8)22-17(29)23-16(19)20;/h3-7,9-11,14H,1-2H3,(H,21,25)(H,27,28)(H5,19,20,22,23,29);/q;+1/p-1/t9-,10-,11+,14-;/m1./s1
| Molecular Formula | C18H21N6O5S |
| Molecular Weight | 433.462 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | Na |
| Molecular Weight | 22.98976928 |
| 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
Mon Mar 31 17:49:19 GMT 2025
by
admin
on
Mon Mar 31 17:49:19 GMT 2025
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| Record UNII |
OUD9J7N2J2
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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OUD9J7N2J2
Created by
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154572815
Created by
admin on Mon Mar 31 17:49:19 GMT 2025 , Edited by admin on Mon Mar 31 17:49:19 GMT 2025
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37762-64-4
Created by
admin on Mon Mar 31 17:49:19 GMT 2025 , Edited by admin on Mon Mar 31 17:49:19 GMT 2025
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
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ACTIVE MOIETY |
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