| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:46 UTC |
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| Update Date | 2025-03-25 00:48:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02166521 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H19NO8 |
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| Molecular Mass | 377.1111 |
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| SMILES | CC(=O)Nc1ccc2ccc(OC3OC(C(=O)O)C(O)C(O)C3O)cc2c1 |
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| InChI Key | GIFKTKZDVQBPQY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | o-glucuronides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetalsacetamidesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsglucuronic acid derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesn-acetylarylaminesnaphthalenesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanesphenol etherspyran carboxylic acidssecondary alcoholssecondary carboxylic acid amides |
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| Substituents | phenol ethercarbonyl groupcarboxylic acidn-acetylarylamineo-glucuronidemonosacchariden-arylamidecarboxylic acid derivativepyran carboxylic acid1-o-glucuronidebeta-hydroxy acidorganic oxideacetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneorganoheterocyclic compoundacetamidealcoholpyran carboxylic acid or derivativeshydroxy acidcarboxamide groupoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativesnaphthalenepyransecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compound |
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