Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C15H20N6O5.H2O |
| Molecular Weight | 382.3718 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 2 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.OC(=O)[C@H](CCC(=O)C=[N+]=[N-])NC(=O)[C@H](CCC(=O)C=[N+]=[N-])NCC=C
InChI
InChIKey=KRLKZYOGLWBFIT-QNTKWALQSA-N
InChI=1S/C15H20N6O5.H2O/c1-2-7-18-12(5-3-10(22)8-19-16)14(24)21-13(15(25)26)6-4-11(23)9-20-17;/h2,8-9,12-13,18H,1,3-7H2,(H,21,24)(H,25,26);1H2/t12-,13-;/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 | C15H20N6O5 |
| Molecular Weight | 364.3565 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 2 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 19:12:43 GMT 2025
by
admin
on
Mon Mar 31 19:12:43 GMT 2025
|
| Record UNII |
5TW8GFA08F
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Preferred Name | English | ||
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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5TW8GFA08F
Created by
admin on Mon Mar 31 19:12:43 GMT 2025 , Edited by admin on Mon Mar 31 19:12:43 GMT 2025
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PRIMARY | |||
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135564902
Created by
admin on Mon Mar 31 19:12:43 GMT 2025 , Edited by admin on Mon Mar 31 19:12:43 GMT 2025
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PRIMARY | |||
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m1471
Created by
admin on Mon Mar 31 19:12:43 GMT 2025 , Edited by admin on Mon Mar 31 19:12:43 GMT 2025
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PRIMARY | Merck Index | ||
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1397-85-9
Created by
admin on Mon Mar 31 19:12:43 GMT 2025 , Edited by admin on Mon Mar 31 19:12:43 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
SALT/SOLVATE -> PARENT | |||
|
ANHYDROUS->SOLVATE |
