| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:10:42 UTC |
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| Update Date | 2025-03-21 18:31:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00087716 |
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| Frequency | 41.9 |
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| Structure | |
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| Chemical Formula | C12H16N4O3 |
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| Molecular Mass | 264.1222 |
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| SMILES | CC(=O)C1CCC(=O)N1C(=O)C(N)Cc1c[nH]cn1 |
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| InChI Key | XLDCOCBGCDKFKM-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 acid amides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundscarboxylic acids and derivativesdicarboximidesheteroaromatic compoundshydrocarbon derivativesimidazolesketonesmonoalkylaminesn-acylpyrrolidinesn-substituted carboxylic acid imidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolidine-2-ones |
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| Substituents | 2-pyrrolidonecarbonyl grouparomatic heteromonocyclic compoundn-acylpyrrolidineketoneorganic oxideimidazoleorganonitrogen compoundalpha-amino acidorganopnictogen compounddicarboximidepyrrolidinecarboxylic acid imide, n-substitutedpyrrolidoneorganoheterocyclic compoundazolealpha-amino acid amideazacycleheteroaromatic compoundcarboxylic acid imideorganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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