| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:48 UTC |
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| Update Date | 2025-03-21 18:02:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00038116 |
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| Frequency | 100.0 |
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| Structure | |
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| Chemical Formula | C10H10N2O4 |
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| Molecular Mass | 222.0641 |
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| SMILES | O=CNc1ccccc1C(=O)NCC(=O)O |
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| InChI Key | NEOGXUMZRKWEGM-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 | acyl glycines |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acylaminobenzoic acid and derivativesalpha amino acidsanilidesbenzoyl derivativescarbonyl compoundscarboxylic acidshippuric acids and derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesn-arylamidesorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidesvinylogous amides |
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| Substituents | monocyclic benzene moietycarbonyl groupcarboxylic acidbenzoyln-arylamidebenzamideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundvinylogous amideacylaminobenzoic acid or derivativeshippuric acid or derivativesbenzoic acid or derivativescarboxamide groupn-acylglycinearomatic homomonocyclic compoundanilidesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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