| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:33:14 UTC |
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| Update Date | 2025-03-21 19:57:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00281278 |
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| Frequency | 7.2 |
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| Structure | |
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| Chemical Formula | C4H9NO3 |
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| Molecular Mass | 119.0582 |
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| SMILES | CNC(O)CC(=O)O |
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| InChI Key | MSQKFQKVMLUKEN-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 acyclic compounds |
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| Alternative Parents | amino acidsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdialkylamineshemiaminalshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundsecondary aliphatic aminecarbonyl groupcarboxylic acidamino acidhydroxy acidsecondary aminebeta amino acid or derivativeshemiaminalbeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundaminealkanolamine |
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