| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:59 UTC |
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| Update Date | 2025-03-25 00:52:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02194323 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H11NO2 |
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| Molecular Mass | 189.079 |
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| SMILES | CN1C2c3ccccc3C1C2C(=O)O |
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| InChI Key | NIWVRPOHFALLGP-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 | isoindoles and derivatives |
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| Subclass | isoindoles |
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| Direct Parent | isoindoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsaralkylaminesazacyclic compoundsazetidinecarboxylic acidsazetidinescarbonyl compoundscarboxylic acidshydrocarbon derivativesindanesisoindolinesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundstrialkylamines |
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| Substituents | carbonyl groupcarboxylic acidamino acid or derivativesamino acidazetidinecarboxylic acidcarboxylic acid derivativearalkylamineorganic oxideisoindolinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundtertiary amineazacycleisoindoletertiary aliphatic amineazetidinemonocarboxylic acid or derivativesorganic oxygen compoundindanehydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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