Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 04:28:49 UTC |
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Update Date | 2025-03-21 23:18:26 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00695393 |
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Frequency | 2.2 |
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Structure | |
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Chemical Formula | C5H5NO2 |
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Molecular Mass | 111.032 |
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SMILES | O=CCc1cnco1 |
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InChI Key | KVHFUTZFNQNZQT-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 | azoles |
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Subclass | oxazoles |
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Direct Parent | oxazoles |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | alpha-hydrogen aldehydesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compounds |
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Substituents | carbonyl grouparomatic heteromonocyclic compoundazacycleheteroaromatic compoundoxazolealdehydeoxacycleorganic oxideorganic oxygen compoundalpha-hydrogen aldehydeorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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