| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:43 UTC |
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| Update Date | 2025-03-25 00:46:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02157367 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H15NO3 |
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| Molecular Mass | 245.1052 |
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| SMILES | O=C1NC2(CCC(C(=O)O)CC2)c2ccccc21 |
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| InChI Key | XTZNIWNDDBNDBC-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 | isoindolines |
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| Direct Parent | isoindolones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidshydrocarbon derivativesisoindoleslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | carbonyl grouplactamcarboxylic acidazacycleisoindolecarboxamide groupcarboxylic acid derivativesecondary carboxylic acid amideisoindoloneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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