Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:38:55 UTC |
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Update Date | 2025-03-25 00:46:06 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02153270 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C11H15NO3 |
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Molecular Mass | 209.1052 |
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SMILES | C=CCOCc1cnc(C)c(O)c1CO |
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InChI Key | OUZJAIKGJYJAKF-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 | pyridoxines |
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Direct Parent | pyridoxines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 2-halopyridinesaromatic alcoholsazacyclic compoundsdialkyl ethersheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridines |
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Substituents | aromatic alcoholalcoholetheraromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridinepyridoxinedialkyl etherorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganooxygen compound |
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