Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | 2C15H17FN4O3.3H2O |
| Molecular Weight | 694.6836 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.CCN1C=C(C(O)=O)C(=O)C2=C1N=C(N3CCNCC3)C(F)=C2.CCN4C=C(C(O)=O)C(=O)C5=C4N=C(N6CCNCC6)C(F)=C5
InChI
InChIKey=DKNNITGJCMPHKE-UHFFFAOYSA-N
InChI=1S/2C15H17FN4O3.3H2O/c2*1-2-19-8-10(15(22)23)12(21)9-7-11(16)14(18-13(9)19)20-5-3-17-4-6-20;;;/h2*7-8,17H,2-6H2,1H3,(H,22,23);3*1H2
| Molecular Formula | C15H17FN4O3 |
| Molecular Weight | 320.3189 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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
Fri Dec 15 15:34:42 UTC 2023
by
admin
on
Fri Dec 15 15:34:42 UTC 2023
|
| Record UNII |
I9CD31N8WB
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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24840537
Created by
admin on Fri Dec 15 15:34:42 UTC 2023 , Edited by admin on Fri Dec 15 15:34:42 UTC 2023
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SUB13675MIG
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admin on Fri Dec 15 15:34:42 UTC 2023 , Edited by admin on Fri Dec 15 15:34:42 UTC 2023
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DTXSID801004596
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admin on Fri Dec 15 15:34:42 UTC 2023 , Edited by admin on Fri Dec 15 15:34:42 UTC 2023
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100000078941
Created by
admin on Fri Dec 15 15:34:42 UTC 2023 , Edited by admin on Fri Dec 15 15:34:42 UTC 2023
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84294-96-2
Created by
admin on Fri Dec 15 15:34:42 UTC 2023 , Edited by admin on Fri Dec 15 15:34:42 UTC 2023
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I9CD31N8WB
Created by
admin on Fri Dec 15 15:34:42 UTC 2023 , Edited by admin on Fri Dec 15 15:34:42 UTC 2023
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m4911
Created by
admin on Fri Dec 15 15:34:42 UTC 2023 , Edited by admin on Fri Dec 15 15:34:42 UTC 2023
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PRIMARY | Merck Index |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |