| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:00:38 UTC |
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| Update Date | 2025-03-24 20:59:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01635126 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C5H9NO2 |
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| Molecular Mass | 115.0633 |
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| SMILES | CN=C(C)CC(=O)O |
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| InChI Key | KIAFXYRVQFAWBG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | fatty acids and conjugates |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary ketimines |
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| Substituents | aliphatic acyclic compoundketiminecarbonyl groupcarboxylic acidiminefatty acidorganic 1,3-dipolar compoundcarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundsecondary ketimineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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