| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:39:35 UTC |
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| Update Date | 2025-03-21 17:58:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00014472 |
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| Frequency | 333.5 |
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| Structure | |
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| Chemical Formula | C7H11NO3 |
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| Molecular Mass | 157.0739 |
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| SMILES | CC(O)C(=O)C1CCC(O)=N1 |
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| InChI Key | PEJOYUPSCWZHKJ-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 | azacyclic compoundscyclic carboximidic acidshydrocarbon derivativesketonesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrrolinessecondary alcohols |
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| Substituents | alcoholazacycleorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundketoneorganic oxidepyrrolineacyloinaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcyclic carboximidic acidorganoheterocyclic compound |
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