Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:37:23 UTC |
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Update Date | 2025-03-21 17:57:40 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00009382 |
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Frequency | 514.6 |
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Structure | |
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Chemical Formula | C6H15NO2 |
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Molecular Mass | 133.1103 |
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SMILES | CC(C)NCC(O)CO |
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InChI Key | YKBZGEJJKPNRSI-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 | 1,2-diols |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | dialkylamineshydrocarbon derivativesorganopnictogen compoundsprimary alcoholssecondary alcohols |
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Substituents | aliphatic acyclic compoundsecondary aliphatic aminesecondary amineorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholamine1,2-diol |
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