| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:20 UTC |
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| Update Date | 2025-03-25 00:49:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02172338 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H18N2O2 |
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| Molecular Mass | 246.1368 |
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| SMILES | CCC1N=C(O)C(Cc2ccccc2)N(C)C1=O |
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| InChI Key | TXMKBVKXXBAIJF-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 | alpha amino acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzene and substituted derivativescarbonyl compoundscarboxylic acids and derivativescyclic carboximidic acidshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundstertiary carboxylic acid amides |
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| Substituents | monocyclic benzene moietycarbonyl grouplactamaromatic heteromonocyclic compoundazacycleorganic 1,3-dipolar compoundcarboxamide grouppropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundtertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundcyclic carboximidic acidorganoheterocyclic compoundorganooxygen compound |
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