Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:25:54 UTC |
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Update Date | 2025-03-21 18:39:10 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00124420 |
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Frequency | 20.7 |
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Structure | |
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Chemical Formula | C19H27N3O8 |
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Molecular Mass | 425.1798 |
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SMILES | NC(CCc1cc(CCC(N)C(=O)O)c(C(=O)O)c(CCC(N)C(=O)O)c1)C(=O)O |
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InChI Key | MZNQYAXDXBZLHV-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 | tetracarboxylic acids and derivatives |
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Direct Parent | tetracarboxylic acids and derivatives |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-carboxy-2-haloaromatic compoundsalpha amino acidsbenzoic acidsbenzoyl derivativescarbonyl compoundshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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Substituents | monocyclic benzene moietycarbonyl groupcarboxylic acidbenzoylbenzoic acid or derivativestetracarboxylic acid or derivativesalpha-amino acid or derivativesaromatic homomonocyclic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativebenzenoidprimary aliphatic amine1-carboxy-2-haloaromatic compoundorganic nitrogen compoundbenzoic acidorganooxygen compound |
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