| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:31 UTC |
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| Update Date | 2025-03-25 00:47:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161328 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H16N2O4 |
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| Molecular Mass | 312.111 |
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| SMILES | NC(Cc1ccccc1)C(=O)OC1Oc2ccccc2NC1=O |
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| InChI Key | FTERQTSWKMMQID-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | phenylalanine and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetalsalpha amino acid estersalpha amino acidsamphetamines and derivativesazacyclic compoundsbenzene and substituted derivativesbenzomorpholinesbenzoxazinonescarbonyl compoundscarboxylic acid estersfatty acid estershydrocarbon derivativeslactamsmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundssecondary carboxylic acid amides |
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| Substituents | fatty acylmonocyclic benzene moietycarbonyl grouplactambenzomorpholineorganic oxideacetalaromatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundamphetamine or derivativesalpha-amino acid esterazacyclebenzoxazinecarboxamide groupoxazinaneoxacyclesecondary carboxylic acid amidefatty acid estermorpholinemonocarboxylic acid or derivativesbenzoxazinonephenylalanine or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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