| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:40:51 UTC |
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| Update Date | 2025-03-24 22:10:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02016616 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C5H5NO3 |
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| Molecular Mass | 127.0269 |
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| SMILES | CC(=O)C1=NOCC1=O |
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| InChI Key | LTDKPQHWQVIGNN-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 | azolines |
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| Subclass | isoxazolines |
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| Direct Parent | isoxazolinones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscyclic ketoneshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | isoxazolinonecarbonyl groupazacyclecyclic ketoneketoneoxacycleorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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