| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:46:26 UTC |
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| Update Date | 2025-03-21 18:00:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00029982 |
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| Frequency | 124.2 |
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| Structure | |
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| Chemical Formula | C6H11N3O |
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| Molecular Mass | 141.0902 |
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| SMILES | CC1=NCCC(C(N)=O)N1 |
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| InChI Key | KUWKLEPOHVMGRX-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 | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamidinesazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acids and derivativeshydrocarbon derivativeshydropyrimidinesimidolactamsorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidespropargyl-type 1,3-dipolar organic compounds |
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| Substituents | primary carboxylic acid amidecarbonyl groupamidinepropargyl-type 1,3-dipolar organic compoundorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidhydropyrimidineorganopnictogen compoundimidolactamorganoheterocyclic compound1,4,5,6-tetrahydropyrimidinealpha-amino acid amideazacycleorganic 1,3-dipolar compoundcarboximidamidecarboxamide grouporganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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