| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:54:30 UTC |
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| Update Date | 2025-03-24 22:24:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01188983 |
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| Frequency | 1.1 |
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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 | NC(=O)C1CC(N)CN1 |
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| InChI Key | CTUKFYWXYDCLIT-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 | proline and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkylamineshydrocarbon derivativesmonoalkylaminesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidespyrrolidinecarboxamides |
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| Substituents | primary carboxylic acid amidecarbonyl grouporganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundproline or derivativessecondary aliphatic aminealpha-amino acid amideazacyclesecondary aminecarboxamide grouppyrrolidine carboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundpyrrolidine-2-carboxamideorganooxygen compoundamine |
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