Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:44:51 UTC |
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Update Date | 2025-03-25 00:48:12 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02166723 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C14H20N4O5 |
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Molecular Mass | 324.1434 |
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SMILES | CC(=O)Nc1c(NCC2CCC(C(=O)O)CC2)[nH]c(=O)[nH]c1=O |
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InChI Key | BFHKCSCJHIYWQK-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic nitrogen compounds |
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Class | organonitrogen compounds |
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Subclass | n-arylamides |
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Direct Parent | n-acetylarylamines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | acetamidesamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundspyrimidonessecondary alkylarylaminessecondary carboxylic acid amidesvinylogous amides |
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Substituents | carbonyl grouplactamcarboxylic acidn-acetylarylaminearomatic heteromonocyclic compoundamino acid or derivativesamino acidpyrimidonecarboxylic acid derivativepyrimidineorganic oxideorganopnictogen compoundorganoheterocyclic compoundacetamidevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundsecondary aminecarboxamide groupsecondary aliphatic/aromatic aminesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compoundamine |
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