Details
Stereochemistry | RACEMIC |
Molecular Formula | C12H15NO3 |
Molecular Weight | 221.2524 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC(OCC2CNC(=O)O2)=CC(C)=C1
InChI
InChIKey=IMWZZHHPURKASS-UHFFFAOYSA-N
InChI=1S/C12H15NO3/c1-8-3-9(2)5-10(4-8)15-7-11-6-13-12(14)16-11/h3-5,11H,6-7H2,1-2H3,(H,13,14)
Molecular Formula | C12H15NO3 |
Molecular Weight | 221.2524 |
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 17:17:02 UTC 2023
by
admin
on
Fri Dec 15 17:17:02 UTC 2023
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Record UNII |
1NMA9J598Y
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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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NDF-RT |
N0000175730
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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LIVERTOX |
NBK548838
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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NDF-RT |
N0000175737
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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NCI_THESAURUS |
C29696
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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Code System | Code | Type | Description | ||
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216-777-6
Created by
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PRIMARY | |||
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SUB08817MIG
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15459
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1722
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METAXALONE
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DTXSID3023269
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m322
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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PRIMARY | Merck Index | ||
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3236
Created by
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PRIMARY | |||
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105801-80-7
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SUPERSEDED | |||
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1NMA9J598Y
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1665-48-1
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7609
Created by
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1396149
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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1NMA9J598Y
Created by
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C011301
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1027
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CHEMBL1079604
Created by
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170959
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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59078
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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PRIMARY | RxNorm | ||
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DB00660
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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100000081199
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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PRIMARY | |||
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C47606
Created by
admin on Fri Dec 15 17:17:02 UTC 2023 , Edited by admin on Fri Dec 15 17:17:02 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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METABOLITE -> PARENT |
MINOR
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METABOLITE -> PARENT | |||
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METABOLITE -> PARENT |
MINOR
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Related Record | Type | Details | ||
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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IMPURITY -> PARENT |
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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||
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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Related Record | Type | Details | ||
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ACTIVE MOIETY |