Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 01:11:08 UTC |
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Update Date | 2025-03-21 19:06:10 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00229875 |
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Frequency | 9.3 |
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Structure | |
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Chemical Formula | C4H9NO2 |
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Molecular Mass | 103.0633 |
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SMILES | OCC1(O)CNC1 |
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InChI Key | SVGVQQICUXXQHI-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | alcohols and polyols |
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Direct Parent | tertiary alcohols |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | 1,2-diolsazacyclic compoundsazetidinesdialkylamineshydrocarbon derivativesorganopnictogen compounds |
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Substituents | secondary aliphatic amineazacyclesecondary amineazetidinetertiary alcoholaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundamine1,2-diol |
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