Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C10H13N5O3S.H2O |
| Molecular Weight | 301.322 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.NC1=NC2=C(N=CN2[C@H]3C[C@H](O)[C@@H](CO)O3)C(=S)N1
InChI
InChIKey=RAKKINBKYJWQIG-FPKZOZHISA-N
InChI=1S/C10H13N5O3S.H2O/c11-10-13-8-7(9(19)14-10)12-3-15(8)6-1-4(17)5(2-16)18-6;/h3-6,16-17H,1-2H2,(H3,11,13,14,19);1H2/t4-,5+,6+;/m0./s1
| 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 |
| Molecular Formula | C10H13N5O3S |
| Molecular Weight | 283.307 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 17:55:45 GMT 2025
by
admin
on
Mon Mar 31 17:55:45 GMT 2025
|
| Record UNII |
Y59HJ22CIA
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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| Code System | Code | Type | Description | ||
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64039-27-6
Created by
admin on Mon Mar 31 17:55:45 GMT 2025 , Edited by admin on Mon Mar 31 17:55:45 GMT 2025
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DTXSID6074881
Created by
admin on Mon Mar 31 17:55:45 GMT 2025 , Edited by admin on Mon Mar 31 17:55:45 GMT 2025
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3048840
Created by
admin on Mon Mar 31 17:55:45 GMT 2025 , Edited by admin on Mon Mar 31 17:55:45 GMT 2025
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Y59HJ22CIA
Created by
admin on Mon Mar 31 17:55:45 GMT 2025 , Edited by admin on Mon Mar 31 17:55:45 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE |
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PARENT -> SALT/SOLVATE |
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