| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:48:57 UTC |
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| Update Date | 2025-03-25 00:49:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02176083 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H10N2O6 |
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| Molecular Mass | 254.0539 |
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| SMILES | Nc1ccc(O)c(C(=O)O)c1C(=O)NCC(=O)O |
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| InChI Key | WAMVHIKLEHGGGE-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 | 1-carboxy-2-haloaromatic compounds1-hydroxy-2-unsubstituted benzenoidsalpha amino acidsamino acidsbenzoic acidsbenzoyl derivativescarbonyl compoundsdicarboxylic acids and derivativeshippuric acids and derivativeshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary aminessalicylic acidssecondary carboxylic acid amidesvinylogous acidsvinylogous amides |
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| Substituents | monocyclic benzene moietycarbonyl groupcarboxylic acidamino acidbenzoyl1-hydroxy-2-unsubstituted benzenoidsalicylic acidbenzamideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compound1-carboxy-2-haloaromatic compoundbenzoic acidvinylogous amidehippuric acid or derivativesbenzoic acid or derivativescarboxamide groupn-acylglycinehydroxybenzoic acidaromatic homomonocyclic compoundsecondary carboxylic acid amidevinylogous acidorganic oxygen compoundsalicylic acid or derivativesdicarboxylic acid or derivativesphenolhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamineorganooxygen compound |
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