| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:02:09 UTC |
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| Update Date | 2025-03-25 00:54:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02206155 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H8N2O3 |
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| Molecular Mass | 204.0535 |
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| SMILES | NC(=O)c1[nH]c(=O)c2ccccc2c1O |
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| InChI Key | IBXVQOAFBNLVDH-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-halopyridines2-heteroaryl carboxamidesazacyclic compoundsbenzenoidscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeshydroxypyridineslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinesprimary carboxylic acid amidespyridinecarboxylic acids and derivativespyridinonesvinylogous acids |
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| Substituents | primary carboxylic acid amidepyridine carboxylic acid or derivativeslactampolyhalopyridinecarboxylic acid derivative2-heteroaryl carboxamideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundisoquinolone2-halopyridineazacycleheteroaromatic compoundhydroxypyridinecarboxamide groupvinylogous acidpyridineorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneorganooxygen compound |
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