Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C26H25N5O2.C4H4O4 |
| Molecular Weight | 555.5812 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 2 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CCOC1=C(NC(=O)\C=C\CN(C)C)C=C2C(=C1)N=CC(C#N)=C2NC3=CC(=CC=C3)C#C
InChI
InChIKey=AXQMBLZSKCUMJL-CNEOMQSYSA-N
InChI=1S/C26H25N5O2.C4H4O4/c1-5-18-9-7-10-20(13-18)29-26-19(16-27)17-28-22-15-24(33-6-2)23(14-21(22)26)30-25(32)11-8-12-31(3)4;5-3(6)1-2-4(7)8/h1,7-11,13-15,17H,6,12H2,2-4H3,(H,28,29)(H,30,32);1-2H,(H,5,6)(H,7,8)/b11-8+;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 | C26H25N5O2 |
| Molecular Weight | 439.509 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 18:37:54 UTC 2023
by
admin
on
Sat Dec 16 18:37:54 UTC 2023
|
| Record UNII |
KEV8HMY439
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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KEV8HMY439
Created by
admin on Sat Dec 16 18:37:54 UTC 2023 , Edited by admin on Sat Dec 16 18:37:54 UTC 2023
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C189802
Created by
admin on Sat Dec 16 18:37:54 UTC 2023 , Edited by admin on Sat Dec 16 18:37:54 UTC 2023
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155923038
Created by
admin on Sat Dec 16 18:37:54 UTC 2023 , Edited by admin on Sat Dec 16 18:37:54 UTC 2023
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1701408-75-4
Created by
admin on Sat Dec 16 18:37:54 UTC 2023 , Edited by admin on Sat Dec 16 18:37:54 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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