Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C9H14N2O.C4H4O4 |
| Molecular Weight | 282.2924 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CC(COC1=CC=CC=C1)NN
InChI
InChIKey=SWGZHHCRMZDRSN-BTJKTKAUSA-N
InChI=1S/C9H14N2O.C4H4O4/c1-8(11-10)7-12-9-5-3-2-4-6-9;5-3(6)1-2-4(7)8/h2-6,8,11H,7,10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;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 | C9H14N2O |
| Molecular Weight | 166.2203 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL2095205 Sources: https://www.ncbi.nlm.nih.gov/pubmed/4401309 |
0.01 mM [Ki] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:50:49 GMT 2025
by
admin
on
Mon Mar 31 22:50:49 GMT 2025
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| Record UNII |
RY8TWH8PRR
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| Record Status |
Validated (UNII)
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RY8TWH8PRR
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3941-06-8
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m885
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admin on Mon Mar 31 22:50:49 GMT 2025 , Edited by admin on Mon Mar 31 22:50:49 GMT 2025
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PRIMARY | Merck Index |
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |