| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:34:58 UTC |
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| Update Date | 2025-03-24 20:23:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01431157 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C6H11NO2 |
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| Molecular Mass | 129.079 |
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| SMILES | NCC1(O)C=CCC1O |
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| InChI Key | QJHOWJCVBXFCTB-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 homomonocyclic compounds |
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| Alternative Parents | 1,2-diolshydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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| Substituents | tertiary alcoholorganonitrogen compoundsecondary alcoholaliphatic homomonocyclic compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound1,2-diol |
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