| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:27:45 UTC |
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| Update Date | 2025-03-25 00:18:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01271021 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C5H9NO3 |
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| Molecular Mass | 131.0582 |
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| SMILES | OC1CNC2OCC1O2 |
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| InChI Key | PUBQURPZJHKOGK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | oxazepines |
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| Subclass | 1,3-oxazepines |
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| Direct Parent | 1,3-oxazepines |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-dioxolanes1,3-oxazinanesazacyclic compoundscarboxylic acid amide acetalsdialkylamineshydrocarbon derivativesorganopnictogen compoundsoxacyclic compoundssecondary alcohols |
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| Substituents | alcoholsecondary aliphatic aminemeta-dioxolaneazacycle1,3-oxazinanesecondary amineoxazinaneamide acetalaliphatic heteropolycyclic compoundoxacycleorganic oxygen compoundmeta-oxazepineorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorthocarboxylic acid derivativeorganooxygen compoundamine |
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