Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C26H26FN7O2.C4H4O4 |
| Molecular Weight | 603.6009 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CN1CCN(CC1)C2=C(F)C=C(NC3=NC(OC4=CC=CC(NC(=O)C=C)=C4)=C5C=CNC5=N3)C=C2
InChI
InChIKey=VRHPZWLHPIENFW-BTJKTKAUSA-N
InChI=1S/C26H26FN7O2.C4H4O4/c1-3-23(35)29-17-5-4-6-19(15-17)36-25-20-9-10-28-24(20)31-26(32-25)30-18-7-8-22(21(27)16-18)34-13-11-33(2)12-14-34;5-3(6)1-2-4(7)8/h3-10,15-16H,1,11-14H2,2H3,(H,29,35)(H2,28,30,31,32);1-2H,(H,5,6)(H,7,8)/b;2-1-
| Molecular Formula | C4H4O4 |
| Molecular Weight | 116.0722 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
| Molecular Formula | C26H26FN7O2 |
| Molecular Weight | 487.5287 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:08:53 UTC 2023
by
admin
on
Sat Dec 16 14:08:53 UTC 2023
|
| Record UNII |
0447KM2XTD
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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121596128
Created by
admin on Sat Dec 16 14:08:54 UTC 2023 , Edited by admin on Sat Dec 16 14:08:54 UTC 2023
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PRIMARY | |||
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C118671
Created by
admin on Sat Dec 16 14:08:54 UTC 2023 , Edited by admin on Sat Dec 16 14:08:54 UTC 2023
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1557268-88-8
Created by
admin on Sat Dec 16 14:08:54 UTC 2023 , Edited by admin on Sat Dec 16 14:08:54 UTC 2023
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PRIMARY | |||
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0447KM2XTD
Created by
admin on Sat Dec 16 14:08:54 UTC 2023 , Edited by admin on Sat Dec 16 14:08:54 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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SOLVATE->ANHYDROUS |
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