| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:55 UTC |
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| Update Date | 2025-03-25 00:54:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02203345 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H7NO6 |
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| Molecular Mass | 225.0273 |
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| SMILES | O=C(O)C=C1C=C(C(=O)O)C=C(C(=O)O)N1 |
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| InChI Key | MOPQTVQFSYKDMX-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 | alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylaminesdihydropyridineshydrocarbon derivativesorganic oxidesorganopnictogen compoundstricarboxylic acids and derivativesvinylogous amides |
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| Substituents | vinylogous amidesecondary aliphatic aminecarbonyl groupcarboxylic acidazacycleamino acidtricarboxylic acid or derivativessecondary amineorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compounddihydropyridineorganoheterocyclic compoundorganooxygen compoundamine |
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