| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:31 UTC |
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| Update Date | 2025-03-25 00:57:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02223355 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H11NO7 |
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| Molecular Mass | 269.0536 |
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| SMILES | NC(Cc1ccc(C(=O)CC(=O)C(=O)O)o1)C(=O)O |
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| InChI Key | YAGHDMWTMJXKLR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | furanoid fatty acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsalpha-hydroxy ketonesalpha-keto acids and derivativesaryl alkyl ketonescarboxylic acidsdicarboxylic acids and derivativesfatty acylsfuroic acid and derivativesgamma-keto acids and derivativesheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | furancarbonyl groupcarboxylic acidaryl alkyl ketonearomatic heteromonocyclic compoundalpha-amino acid or derivativesalpha-hydroxy ketonecarboxylic acid derivativeketoneorganic oxideorganonitrogen compoundalpha-keto acidalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundfuranoid fatty acidfuroic acid or derivativesheteroaromatic compoundgamma-keto acidoxacycleorganic oxygen compoundketo aciddicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundaryl ketone |
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