Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C23H22F2N4O4 |
| Molecular Weight | 456.442 |
| Optical Activity | ( + ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1N=NN=C1C(\C=C\[C@@H](O)C[C@@H](O)CC(O)=O)=C(C2=CC=C(F)C=C2)C3=CC=C(F)C=C3
InChI
InChIKey=HPFIYXJJZZWEPC-MMKWGKFASA-N
InChI=1S/C23H22F2N4O4/c1-29-23(26-27-28-29)20(11-10-18(30)12-19(31)13-21(32)33)22(14-2-6-16(24)7-3-14)15-4-8-17(25)9-5-15/h2-11,18-19,30-31H,12-13H2,1H3,(H,32,33)/b11-10+/t18-,19-/m1/s1
| Molecular Formula | C23H22F2N4O4 |
| Molecular Weight | 456.442 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 13:42:52 UTC 2023
by
admin
on
Sat Dec 16 13:42:52 UTC 2023
|
| Record UNII |
LU1PQR90RM
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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129785-03-1
Created by
admin on Sat Dec 16 13:42:52 UTC 2023 , Edited by admin on Sat Dec 16 13:42:52 UTC 2023
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6442423
Created by
admin on Sat Dec 16 13:42:52 UTC 2023 , Edited by admin on Sat Dec 16 13:42:52 UTC 2023
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PRIMARY | |||
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LU1PQR90RM
Created by
admin on Sat Dec 16 13:42:52 UTC 2023 , Edited by admin on Sat Dec 16 13:42:52 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
RACEMATE -> ACTIVE ENANTIOMER | |||
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SALT/SOLVATE -> PARENT | |||
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DIASTEREOISOMER -> EPIMER | |||
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TARGET -> INHIBITOR | |||
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SALT/SOLVATE -> PARENT | |||
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ENANTIOMER -> ENANTIOMER |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
