Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:42:57 UTC |
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Update Date | 2025-03-25 00:47:32 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02162333 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C14H17N3O8 |
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Molecular Mass | 355.1016 |
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SMILES | O=C(O)CCC(NN=CC=C1C=C(C(=O)O)NC(C(=O)O)C1)C(=O)O |
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InChI Key | GNUPJVBZRFPCLD-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 | glutamic acid and derivatives |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylamineshydrazoneshydrocarbon derivativesorganic oxidesorganopnictogen compoundstetracarboxylic acids and derivativestetrahydropyridines |
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Substituents | carbonyl groupcarboxylic acidamino acidhydrazoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundsecondary aliphatic amineazacycletetrahydropyridinetetracarboxylic acid or derivativesglutamic acid or derivativessecondary amineorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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