Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C15H13F3N2O4 |
| Molecular Weight | 342.2699 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC[C@H]1CN(C(=O)O1)C2=CC(F)=C(N3CCC(=O)C=C3)C(F)=C2F
InChI
InChIKey=PQYCYMNPZGRPTE-SECBINFHSA-N
InChI=1S/C15H13F3N2O4/c16-10-5-11(20-6-9(7-21)24-15(20)23)12(17)13(18)14(10)19-3-1-8(22)2-4-19/h1,3,5,9,21H,2,4,6-7H2/t9-/m1/s1
| Molecular Formula | C15H13F3N2O4 |
| Molecular Weight | 342.2699 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:42:42 GMT 2023
by
admin
on
Sat Dec 16 15:42:42 GMT 2023
|
| Record UNII |
XKM70G2TJ4
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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XKM70G2TJ4
Created by
admin on Sat Dec 16 15:42:42 GMT 2023 , Edited by admin on Sat Dec 16 15:42:42 GMT 2023
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1112968-16-7
Created by
admin on Sat Dec 16 15:42:42 GMT 2023 , Edited by admin on Sat Dec 16 15:42:42 GMT 2023
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25184463
Created by
admin on Sat Dec 16 15:42:42 GMT 2023 , Edited by admin on Sat Dec 16 15:42:42 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
FECAL; PLASMA; URINE
|
