| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:45 UTC |
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| Update Date | 2025-03-25 00:46:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02155265 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H13N3O3 |
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| Molecular Mass | 271.0957 |
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| SMILES | Cc1cc2c(=O)[nH]c3[nH]c(=O)n(C)c(=O)c3c2cc1C |
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| InChI Key | JACVIYIMTPPWNP-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 | isoquinolines and derivatives |
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| Subclass | isoquinolones and derivatives |
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| Direct Parent | isoquinolones and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeslactamsmethylpyridinesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridinonespyrido[2,3-d]pyrimidinespyrimidonesvinylogous amides |
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| Substituents | lactampolyhalopyridinepyrimidonepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundpyridopyrimidineorganopnictogen compoundisoquinolone2-halopyridinevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundmethylpyridinepyridineorganic oxygen compoundpyrido[2,3-d]pyrimidinehydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneorganooxygen compound |
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