Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C14H16N6O2 |
| Molecular Weight | 300.3158 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NC1=NC2=C(N=CN2[C@@H]3C[C@@H](C=C3)C(O)=O)C(NC4CC4)=N1
InChI
InChIKey=OCSMNHMMTKMVCP-APPZFPTMSA-N
InChI=1S/C14H16N6O2/c15-14-18-11(17-8-2-3-8)10-12(19-14)20(6-16-10)9-4-1-7(5-9)13(21)22/h1,4,6-9H,2-3,5H2,(H,21,22)(H3,15,17,18,19)/t7-,9+/m1/s1
| Molecular Formula | C14H16N6O2 |
| Molecular Weight | 300.3158 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:17:42 UTC 2023
by
admin
on
Sat Dec 16 11:17:42 UTC 2023
|
| Record UNII |
FO2D75G53I
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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FO2D75G53I
Created by
admin on Sat Dec 16 11:17:42 UTC 2023 , Edited by admin on Sat Dec 16 11:17:42 UTC 2023
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PRIMARY | |||
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DTXSID40718879
Created by
admin on Sat Dec 16 11:17:42 UTC 2023 , Edited by admin on Sat Dec 16 11:17:42 UTC 2023
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56927907
Created by
admin on Sat Dec 16 11:17:42 UTC 2023 , Edited by admin on Sat Dec 16 11:17:42 UTC 2023
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384380-52-3
Created by
admin on Sat Dec 16 11:17:42 UTC 2023 , Edited by admin on Sat Dec 16 11:17:42 UTC 2023
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64192
Created by
admin on Sat Dec 16 11:17:42 UTC 2023 , Edited by admin on Sat Dec 16 11:17:42 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE INACTIVE |
83% of the original dose was eliminated in the urine, and 16% in the feces
MAJOR
FECAL; URINE
|
