| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:03:05 UTC |
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| Update Date | 2025-03-21 18:07:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00069531 |
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| Frequency | 43.4 |
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| Structure | |
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| Chemical Formula | C6H7NO5 |
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| Molecular Mass | 173.0324 |
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| SMILES | NC(=O)CC(=CC(=O)O)C(=O)O |
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| InChI Key | RSBNKBGDTLMWIR-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 | branched fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesfatty amideshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidesunsaturated fatty acids |
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| Substituents | primary carboxylic acid amidealiphatic acyclic compoundcarbonyl groupcarboxylic acidfatty amidecarboxamide groupcarboxylic acid derivativebranched fatty acidunsaturated fatty acidorganic oxideorganic oxygen compoundorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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