| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:20:52 UTC |
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| Update Date | 2025-03-21 20:53:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00392404 |
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| Frequency | 4.7 |
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| Structure | |
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| Chemical Formula | C4H9N3O |
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| Molecular Mass | 115.0746 |
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| SMILES | NCC1NCNC1=O |
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| InChI Key | SLRJNJJEOVHGSV-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 derivativesimidazolidinoneslactamsmonoalkylaminesorganic oxidesorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | imidazolidinecarbonyl grouplactamalpha-amino acid or derivativesimidazolidinoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundsecondary aliphatic amineazacyclesecondary aminecarboxamide groupbeta amino acid or derivativessecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamine |
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