Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H22N4O4S.3H2O |
| Molecular Weight | 420.481 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.C[C@@H]1CCCN1C(=O)[C@H](CC2=CSC=N2)NC(=O)[C@H]3NC(=O)O[C@H]3C
InChI
InChIKey=OKGVIMQQOHBRRH-RYNPTWSUSA-N
InChI=1S/C16H22N4O4S.3H2O/c1-9-4-3-5-20(9)15(22)12(6-11-7-25-8-17-11)18-14(21)13-10(2)24-16(23)19-13;;;/h7-10,12-13H,3-6H2,1-2H3,(H,18,21)(H,19,23);3*1H2/t9-,10+,12+,13+;;;/m1.../s1
| Molecular Formula | C16H22N4O4S |
| Molecular Weight | 366.435 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| 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
Sat Dec 16 12:51:56 UTC 2023
by
admin
on
Sat Dec 16 12:51:56 UTC 2023
|
| Record UNII |
G5O9D3ZK7O
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Code System | Code | Type | Description | ||
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11567968
Created by
admin on Sat Dec 16 12:51:56 UTC 2023 , Edited by admin on Sat Dec 16 12:51:56 UTC 2023
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879122-87-9
Created by
admin on Sat Dec 16 12:51:56 UTC 2023 , Edited by admin on Sat Dec 16 12:51:56 UTC 2023
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PRIMARY | |||
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G5O9D3ZK7O
Created by
admin on Sat Dec 16 12:51:56 UTC 2023 , Edited by admin on Sat Dec 16 12:51:56 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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ANHYDROUS->SOLVATE |
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| Related Record | Type | Details | ||
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ACTIVE MOIETY |