Details
Stereochemistry | RACEMIC |
Molecular Formula | C12H20N2O3.C2H4O2 |
Molecular Weight | 300.3508 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(O)=O.CC(C)(C)NCC(O)C1=NC(CO)=C(O)C=C1
InChI
InChIKey=QSXMZJGGEWYVCN-UHFFFAOYSA-N
InChI=1S/C12H20N2O3.C2H4O2/c1-12(2,3)13-6-11(17)8-4-5-10(16)9(7-15)14-8;1-2(3)4/h4-5,11,13,15-17H,6-7H2,1-3H3;1H3,(H,3,4)
Molecular Formula | C12H20N2O3 |
Molecular Weight | 240.2988 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Molecular Formula | C2H4O2 |
Molecular Weight | 60.052 |
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
Fri Dec 15 15:25:35 UTC 2023
by
admin
on
Fri Dec 15 15:25:35 UTC 2023
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Record UNII |
1EH73XKR9N
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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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NCI_THESAURUS |
C48149
Created by
admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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Code System | Code | Type | Description | ||
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65652-44-0
Created by
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1EH73XKR9N
Created by
admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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CHEMBL1094966
Created by
admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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171674
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221142
Created by
admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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PRIMARY | RxNorm | ||
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C47675
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admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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DTXSID40984214
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admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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m8872
Created by
admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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PRIMARY | Merck Index | ||
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DBSALT000799
Created by
admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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100000092607
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265-862-4
Created by
admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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SUB03867MIG
Created by
admin on Fri Dec 15 15:25:35 UTC 2023 , Edited by admin on Fri Dec 15 15:25:35 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |