Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 09:17:42 UTC |
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Update Date | 2025-03-24 20:15:28 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01389477 |
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Frequency | 0.9 |
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Structure | |
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Chemical Formula | C5H9NO |
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Molecular Mass | 99.0684 |
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SMILES | OC1C=CNCC1 |
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InChI Key | FGTYPPVXKJSFPR-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 | hydropyridines |
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Direct Parent | tetrahydropyridines |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundsdialkylamineshydrocarbon derivativesorganopnictogen compoundssecondary alcohols |
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Substituents | alcoholsecondary aliphatic amineazacycletetrahydropyridinesecondary amineorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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