| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:31:55 UTC |
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| Update Date | 2025-03-21 22:49:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00560953 |
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| Frequency | 2.9 |
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| Structure | |
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| Chemical Formula | C6H9NO3 |
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| Molecular Mass | 143.0582 |
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| SMILES | NC(=O)CCC=CC(=O)O |
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| InChI Key | XEDAPZUWZHMTLK-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 | medium-chain fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | amino fatty acidscarbonyl compoundscarboxylic acidsfatty amideshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidesstraight chain fatty acidsunsaturated fatty acids |
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| Substituents | primary carboxylic acid amidealiphatic acyclic compoundcarbonyl groupstraight chain fatty acidcarboxylic acidfatty amidecarboxamide groupcarboxylic acid derivativeamino fatty acidunsaturated fatty acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganooxygen compound |
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