Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 13:52:05 UTC |
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Update Date | 2025-03-25 00:29:16 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02043295 |
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Frequency | 0.6 |
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Structure | |
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Chemical Formula | C4H9NO3 |
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Molecular Mass | 119.0582 |
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SMILES | CON=C(O)C(C)O |
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InChI Key | NBZMTXOQGVHQDC-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 | secondary alcohols |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | hydrocarbon derivativesorganonitrogen compoundsorganopnictogen compounds |
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Substituents | aliphatic acyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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