Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:27:20 UTC |
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Update Date | 2025-03-21 18:39:56 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00127866 |
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Frequency | 20.0 |
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Structure | |
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Chemical Formula | C8H11NO3 |
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Molecular Mass | 169.0739 |
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SMILES | CC(O)Cn1ccc(=O)c(O)c1 |
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InChI Key | IIVGVEVQKGSRDJ-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 compoundscyclic ketonesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary alcoholsvinylogous amides |
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Substituents | alcoholvinylogous amidearomatic heteromonocyclic compoundazacycleheteroaromatic compoundhydroxypyridinemethylpyridinecyclic ketoneorganic oxideorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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