| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:07:43 UTC |
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| Update Date | 2025-03-21 19:04:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00222182 |
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| Frequency | 9.8 |
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| Structure | |
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| Chemical Formula | C5H11N3O |
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| Molecular Mass | 129.0902 |
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| SMILES | NCC1NCCNC1=O |
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| InChI Key | KPUMNYLGNQFAPZ-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 | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkylamineshydrocarbon derivativeslactamsmonoalkylaminesorganic oxidesorganopnictogen compoundspiperazinessecondary carboxylic acid amides |
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| Substituents | carbonyl grouplactamalpha-amino acid or derivativesorganic oxidepiperazinealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundsecondary aliphatic amineazacyclesecondary aminecarboxamide groupbeta amino acid or derivativessecondary carboxylic acid amideorganic oxygen compound1,4-diazinanehydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamine |
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