| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:31:02 UTC |
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| Update Date | 2025-03-21 18:41:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00136410 |
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| Frequency | 18.4 |
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| Structure | |
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| Chemical Formula | C11H14N2O |
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| Molecular Mass | 190.1106 |
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| SMILES | NC(=O)CC1NCCc2ccccc21 |
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| InChI Key | UOXQNIJEKNXFNJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | beta amino acids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativesdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidestetrahydroisoquinolines |
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| Substituents | primary carboxylic acid amidesecondary aliphatic aminecarbonyl groupazacyclesecondary aminecarboxamide groupbeta amino acid or derivativesorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundtetrahydroisoquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundamine |
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