| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:57 UTC |
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| Update Date | 2025-03-25 01:00:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02242297 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16N2O |
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| Molecular Mass | 204.1263 |
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| SMILES | CC(C)NC(=O)C1Cc2ccccc2N1 |
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| InChI Key | CMAXROOFJXSODT-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 | indoles and derivatives |
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| Subclass | indolecarboxylic acids and derivatives |
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| Direct Parent | indolecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesindolesindolinesorganic oxidesorganopnictogen compoundssecondary alkylarylaminessecondary carboxylic acid amides |
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| Substituents | carbonyl groupamino acid or derivativesindolealpha-amino acid or derivativescarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compounddihydroindoleindolecarboxylic acid derivativealpha-amino acid amideazacyclesecondary aminecarboxamide groupsecondary aliphatic/aromatic aminesecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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