| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:35:23 UTC |
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| Update Date | 2025-03-24 20:23:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01432048 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C6H9NO3 |
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| Molecular Mass | 143.0582 |
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| SMILES | CC(=O)C(O)C1=NCCO1 |
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| InChI Key | YMGGNEKBKHFQRM-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 | alpha-hydroxy ketonesazacyclic compoundshydrocarbon derivativesimidoestersorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxazolinespropargyl-type 1,3-dipolar organic compoundssecondary alcohols |
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| Substituents | alcoholazacycleorganic 1,3-dipolar compoundalpha-hydroxy ketoneimido esterpropargyl-type 1,3-dipolar organic compoundketoneoxacycleoxazolineorganic oxideacyloinaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compound |
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