Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:45:46 UTC |
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Update Date | 2025-03-21 18:00:37 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00028440 |
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Frequency | 132.3 |
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Structure | |
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Chemical Formula | C15H19NO8 |
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Molecular Mass | 341.1111 |
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SMILES | CC(=O)Nc1ccc(OC2C(O)C(O)C(O)C(O)C2C(=O)O)cc1 |
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InChI Key | JMIOEZVYSFDOLI-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | benzene and substituted derivatives |
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Subclass | anilides |
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Direct Parent | acetanilides |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | acetamidesalkyl aryl ethersbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidscyclitols and derivativescyclohexanolshydrocarbon derivativesmonocarboxylic acids and derivativesn-acetylarylaminesorganic oxidesorganopnictogen compoundsphenol ethersphenoxy compoundssecondary carboxylic acid amides |
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Substituents | phenol ethercarbonyl groupethercarboxylic acidn-acetylarylaminen-arylamidealkyl aryl ethercarboxylic acid derivativebeta-hydroxy acidorganic oxideorganonitrogen compoundorganopnictogen compoundacetamidealcoholacetanilidecyclohexanolcyclitol or derivativeshydroxy acidcyclic alcoholcarboxamide grouparomatic homomonocyclic compoundsecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compound |
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