| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:47:44 UTC |
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| Update Date | 2025-03-24 20:54:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01603989 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C6H8N2O2 |
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| Molecular Mass | 140.0586 |
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| SMILES | O=C1NC(=O)C2CCC1N2 |
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| InChI Key | WBKAUNHCLBEXAX-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 | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsazepanescaprolactamscarbonyl compoundscarboxylic acids and derivativesdialkylaminesdicarboximidesdioxopiperazineshydrocarbon derivativesn-unsubstituted carboxylic acid imidesorganic oxidesorganopnictogen compoundspyrrolidines |
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| Substituents | caprolactamcarbonyl grouplactamaliphatic heteropolycyclic compoundcarboxylic acid imide, n-unsubstitutedorganic oxidedioxopiperazinepiperazineorganonitrogen compoundalpha-amino acidorganopnictogen compounddicarboximidepyrrolidineorganoheterocyclic compoundsecondary aliphatic amineazacyclesecondary aminecarboxylic acid imideazepaneorganic oxygen compound1,4-diazinanehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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