Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C22H20N2O5 |
| Molecular Weight | 392.4046 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(CCOC2=CC=C(CC3C(=O)NOC3=O)C=C2)N=C(O1)C4=CC=CC=C4
InChI
InChIKey=QBQLYIISSRXYKL-UHFFFAOYSA-N
InChI=1S/C22H20N2O5/c1-14-19(23-21(28-14)16-5-3-2-4-6-16)11-12-27-17-9-7-15(8-10-17)13-18-20(25)24-29-22(18)26/h2-10,18H,11-13H2,1H3,(H,24,25)
| Molecular Formula | C22H20N2O5 |
| Molecular Weight | 392.4046 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:41:58 UTC 2023
by
admin
on
Fri Dec 15 15:41:58 UTC 2023
|
| Record UNII |
P9UTN18JVV
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C98233
Created by
admin on Fri Dec 15 15:41:58 UTC 2023 , Edited by admin on Fri Dec 15 15:41:58 UTC 2023
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| Code System | Code | Type | Description | ||
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8042
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300000034435
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DB04971
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admin on Fri Dec 15 15:41:58 UTC 2023 , Edited by admin on Fri Dec 15 15:41:58 UTC 2023
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C98152
Created by
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P9UTN18JVV
Created by
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CHEMBL293526
Created by
admin on Fri Dec 15 15:41:58 UTC 2023 , Edited by admin on Fri Dec 15 15:41:58 UTC 2023
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154000
Created by
admin on Fri Dec 15 15:41:58 UTC 2023 , Edited by admin on Fri Dec 15 15:41:58 UTC 2023
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170861-63-9
Created by
admin on Fri Dec 15 15:41:58 UTC 2023 , Edited by admin on Fri Dec 15 15:41:58 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ENANTIOMER -> RACEMATE |
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TARGET -> AGONIST |
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ENANTIOMER -> RACEMATE |
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TARGET -> AGONIST |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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