Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C14H20ClN3O3 |
| Molecular Weight | 313.78 |
| Optical Activity | ( + ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CO[C@H]1CNCC[C@H]1NC(=O)C2=C(OC)C=C(N)C(Cl)=C2
InChI
InChIKey=OMLDMGPCWMBPAN-YPMHNXCESA-N
InChI=1S/C14H20ClN3O3/c1-20-12-6-10(16)9(15)5-8(12)14(19)18-11-3-4-17-7-13(11)21-2/h5-6,11,13,17H,3-4,7,16H2,1-2H3,(H,18,19)/t11-,13+/m1/s1
| Molecular Formula | C14H20ClN3O3 |
| Molecular Weight | 313.78 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 16:47:03 UTC 2023
by
admin
on
Sat Dec 16 16:47:03 UTC 2023
|
| Record UNII |
QNG273A81O
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C257
Created by
admin on Sat Dec 16 16:47:03 UTC 2023 , Edited by admin on Sat Dec 16 16:47:03 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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202590-69-0
Created by
admin on Sat Dec 16 16:47:03 UTC 2023 , Edited by admin on Sat Dec 16 16:47:03 UTC 2023
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QNG273A81O
Created by
admin on Sat Dec 16 16:47:03 UTC 2023 , Edited by admin on Sat Dec 16 16:47:03 UTC 2023
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DB06422
Created by
admin on Sat Dec 16 16:47:03 UTC 2023 , Edited by admin on Sat Dec 16 16:47:03 UTC 2023
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7993
Created by
admin on Sat Dec 16 16:47:03 UTC 2023 , Edited by admin on Sat Dec 16 16:47:03 UTC 2023
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C73037
Created by
admin on Sat Dec 16 16:47:03 UTC 2023 , Edited by admin on Sat Dec 16 16:47:03 UTC 2023
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CHEMBL2107465
Created by
admin on Sat Dec 16 16:47:03 UTC 2023 , Edited by admin on Sat Dec 16 16:47:03 UTC 2023
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300000036923
Created by
admin on Sat Dec 16 16:47:03 UTC 2023 , Edited by admin on Sat Dec 16 16:47:03 UTC 2023
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PRIMARY | |||
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216236
Created by
admin on Sat Dec 16 16:47:03 UTC 2023 , Edited by admin on Sat Dec 16 16:47:03 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
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TARGET -> AGONIST |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
FECAL; PLASMA; URINE
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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