Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C28H30N4O3.C2HF3O2 |
| Molecular Weight | 584.5861 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)C1=CC=C(CNCC2=CNC=N2)C=C1C3=C4C=CC=CC4=CC=C3)C(O)=O
InChI
InChIKey=ZPGBSZFISMYJFY-SNYZSRNZSA-N
InChI=1S/C28H30N4O3.C2HF3O2/c1-18(2)12-26(28(34)35)32-27(33)24-11-10-19(14-29-15-21-16-30-17-31-21)13-25(24)23-9-5-7-20-6-3-4-8-22(20)23;3-2(4,5)1(6)7/h3-11,13,16-18,26,29H,12,14-15H2,1-2H3,(H,30,31)(H,32,33)(H,34,35);(H,6,7)/t26-;/m0./s1
| Molecular Formula | C2HF3O2 |
| Molecular Weight | 114.0233 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C28H30N4O3 |
| Molecular Weight | 470.5628 |
| 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 08:31:17 GMT 2023
by
admin
on
Sat Dec 16 08:31:17 GMT 2023
|
| Record UNII |
PMW8NVD3T6
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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PMW8NVD3T6
Created by
admin on Sat Dec 16 08:31:17 GMT 2023 , Edited by admin on Sat Dec 16 08:31:17 GMT 2023
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9938282
Created by
admin on Sat Dec 16 08:31:17 GMT 2023 , Edited by admin on Sat Dec 16 08:31:17 GMT 2023
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225938-39-6
Created by
admin on Sat Dec 16 08:31:17 GMT 2023 , Edited by admin on Sat Dec 16 08:31:17 GMT 2023
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| Related Record | Type | Details | ||
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