| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:49 UTC |
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| Update Date | 2025-03-25 00:51:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02187234 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H20N2O9 |
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| Molecular Mass | 384.1169 |
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| SMILES | CC(=O)Nc1ccccc1OC1OC(C(=O)C(N)C(=O)O)C(O)C(O)C1O |
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| InChI Key | BGOLEWTZGTXGPG-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 heteromonocyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compoundsacetalsacetamidesalpha amino acidsbeta-hydroxy ketonesbeta-keto acids and derivativescarboxylic acidshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesmonosaccharidesn-acetylarylaminesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanesphenol ethersphenoxy compoundssecondary alcoholssecondary carboxylic acid amides |
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| Substituents | beta-hydroxy ketonephenol ethercarbonyl groupcarboxylic acidn-acetylarylaminearomatic heteromonocyclic compoundmonosacchariden-arylamidealpha-amino acid or derivativescarboxylic acid derivativebeta-keto acidketonesaccharideorganic oxideacetalorganonitrogen compoundalpha-amino acidorganopnictogen compoundoxaneorganoheterocyclic compoundacetamidealcoholacetanilidecarboxamide groupoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundketo acidsecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound1,3-dicarbonyl compoundphenoxy compoundorganooxygen compound |
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