Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:57:55 UTC |
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Update Date | 2025-03-21 18:05:29 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00057224 |
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Frequency | 55.5 |
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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 | NCC=CCC(=O)O |
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InChI Key | IACMVGAGEKETDA-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 | straight chain fatty acids |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acidsfatty acylshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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Substituents | aliphatic acyclic compoundcarbonyl groupstraight chain fatty acidcarboxylic acidcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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