| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:36:18 UTC |
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| Update Date | 2025-03-21 17:57:17 UTC |
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| HMDB ID | HMDB0254349 |
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| Metabolite Identification |
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| DeepMet ID | DMID00006843 |
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| Name | Mavacoxib |
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| Frequency | 748.5 |
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| Structure | |
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| Chemical Formula | C16H11F4N3O2S |
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| Molecular Mass | 385.0508 |
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| SMILES | NS(=O)(=O)c1ccc(-n2nc(C(F)(F)F)cc2-c2ccc(F)cc2)cc1 |
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| InChI Key | TTZNQDOUNXBMJV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | azoles |
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| Subclass | pyrazoles |
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| Direct Parent | phenylpyrazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl fluoridesaminosulfonyl compoundsaryl fluoridesazacyclic compoundsbenzenesulfonamidesbenzenesulfonyl compoundsfluorobenzenesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganofluoridesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamides |
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| Substituents | aryl fluorideorganosulfonic acid or derivativesmonocyclic benzene moietyaromatic heteromonocyclic compoundorganosulfur compoundorganohalogen compoundorganosulfonic acid amidephenylpyrazolefluorobenzeneorganic oxideorganonitrogen compoundorganopnictogen compoundalkyl halidebenzenesulfonyl groupbenzenesulfonamideazacycleaminosulfonyl compoundalkyl fluorideorganofluorideheteroaromatic compoundaryl halidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzene |
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