| 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 | DMID02194290 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H16N2O |
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| Molecular Mass | 228.1263 |
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| SMILES | CN1CCC(=C2NC(=O)c3ccccc32)CC1 |
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| InChI Key | WWDVDUFPEDXHIE-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 | amino acids and derivativesazacyclic compoundsbenzenoidscarboxylic acids and derivativeshydrocarbon derivativesisoindoleslactamsorganic oxidesorganooxygen compoundsorganopnictogen compoundspiperidinessecondary carboxylic acid amidestrialkylamines |
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| Substituents | lactamamino acid or derivativescarboxylic acid derivativeisoindoloneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpiperidinetertiary amineazacycleisoindoletertiary aliphatic aminecarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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