| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:15:19 UTC |
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| Update Date | 2025-03-24 20:14:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01384051 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C7H13NO2 |
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| Molecular Mass | 143.0946 |
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| SMILES | CNCCCC=CC(=O)O |
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| InChI Key | SBXXUYZGUDKUBN-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 acidsamino fatty acidscarbonyl compoundscarboxylic acidsdialkylamineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsstraight chain fatty acidsunsaturated fatty acids |
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| Substituents | aliphatic acyclic compoundsecondary aliphatic aminecarbonyl groupstraight chain fatty acidcarboxylic acidamino acid or derivativesamino acidsecondary aminecarboxylic acid derivativeamino fatty acidunsaturated fatty acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganooxygen compoundamine |
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