Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H13F3N4O4 |
| Molecular Weight | 406.3154 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
FC1=C(N2C=CC(=O)C=C2)C(F)=C(F)C(=C1)N3C[C@H](CNC4=NOC=C4)OC3=O
InChI
InChIKey=MLDHDLNJYAQXKP-NSHDSACASA-N
InChI=1S/C18H13F3N4O4/c19-12-7-13(15(20)16(21)17(12)24-4-1-10(26)2-5-24)25-9-11(29-18(25)27)8-22-14-3-6-28-23-14/h1-7,11H,8-9H2,(H,22,23)/t11-/m0/s1
| Molecular Formula | C18H13F3N4O4 |
| Molecular Weight | 406.3154 |
| 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 15:42:47 GMT 2023
by
admin
on
Sat Dec 16 15:42:47 GMT 2023
|
| Record UNII |
BY6A6N1BOI
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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1879031-64-7
Created by
admin on Sat Dec 16 15:42:47 GMT 2023 , Edited by admin on Sat Dec 16 15:42:47 GMT 2023
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BY6A6N1BOI
Created by
admin on Sat Dec 16 15:42:47 GMT 2023 , Edited by admin on Sat Dec 16 15:42:47 GMT 2023
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145996760
Created by
admin on Sat Dec 16 15:42:47 GMT 2023 , Edited by admin on Sat Dec 16 15:42:47 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
FECAL; PLASMA; URINE
|
