| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:40 UTC |
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| Update Date | 2025-03-25 01:01:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02246373 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H13NO4 |
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| Molecular Mass | 199.0845 |
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| SMILES | CC1=C(C(=O)O)CC(C(=O)C(C)O)N1 |
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| InChI Key | XOAOXRAXBULJBW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | acyloins |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarboxylic acidsdialkylamineshydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspyrrolinessecondary alcoholsvinylogous amides |
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| Substituents | carboxylic acidamino acid or derivativesamino acidcarboxylic acid derivativeketoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundalcoholvinylogous amidesecondary aliphatic amineazacyclesecondary aminemonocarboxylic acid or derivativespyrrolineacyloinsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamine |
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