Details
Stereochemistry | RACEMIC |
Molecular Formula | C9H11NO5.ClH |
Molecular Weight | 249.648 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.NC(CC1=C(O)C=C(O)C(O)=C1)C(O)=O
InChI
InChIKey=BFABEGDECPTTRS-UHFFFAOYSA-N
InChI=1S/C9H11NO5.ClH/c10-5(9(14)15)1-4-2-7(12)8(13)3-6(4)11;/h2-3,5,11-13H,1,10H2,(H,14,15);1H
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL5619 |
0.11 µM [IC50] | ||
Target ID: CHEMBL2362978 Sources: https://www.ncbi.nlm.nih.gov/pubmed/26548611 |
1.1 µM [IC50] |
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168441272
Created by
admin on Sat Dec 16 20:17:56 GMT 2023 , Edited by admin on Sat Dec 16 20:17:56 GMT 2023
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FQJ6LEK5R9
Created by
admin on Sat Dec 16 20:17:56 GMT 2023 , Edited by admin on Sat Dec 16 20:17:56 GMT 2023
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68463-64-9
Created by
admin on Sat Dec 16 20:17:56 GMT 2023 , Edited by admin on Sat Dec 16 20:17:56 GMT 2023
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PARENT (SALT/SOLVATE)
SUBSTANCE RECORD