Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:18:01 UTC |
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Update Date | 2025-03-21 18:35:24 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00105467 |
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Frequency | 25.6 |
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Structure | |
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Chemical Formula | C9H9NO3 |
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Molecular Mass | 179.0582 |
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SMILES | O=C1OC(c2cccnc2)CC1O |
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InChI Key | ORJKVSGLTCWXFY-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 | pyridines and derivatives |
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Subclass | hydroxypyridines |
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Direct Parent | hydroxypyridines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acid estersgamma butyrolactonesheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundssecondary alcoholstetrahydrofurans |
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Substituents | alcoholcarbonyl grouparomatic heteromonocyclic compoundazacycletetrahydrofuranheteroaromatic compoundhydroxypyridinecarboxylic acid derivativegamma butyrolactonelactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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