| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:05:22 UTC |
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| Update Date | 2025-03-21 18:28:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00074999 |
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| Frequency | 39.5 |
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| Structure | |
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| Chemical Formula | C11H10N2O3 |
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| Molecular Mass | 218.0691 |
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| SMILES | CC(=O)Nc1ccc2[nH]cc(C(=O)O)c2c1 |
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| InChI Key | NNINUKASLGCUSR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | indoles and derivatives |
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| Subclass | indolecarboxylic acids and derivatives |
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| Direct Parent | indolecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compoundsacetamidesazacyclic compoundsbenzenoidscarbonyl compoundsheteroaromatic compoundshydrocarbon derivativesindolesmonocarboxylic acids and derivativesn-acetylarylaminesorganic oxidesorganopnictogen compoundspyrrole carboxylic acidssecondary carboxylic acid amidesvinylogous amides |
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| Substituents | carbonyl groupcarboxylic acidn-acetylarylaminepyrrole-3-carboxylic acid or derivativesindolen-arylamidecarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compoundacetamideindolecarboxylic acid derivativevinylogous amideazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundpyrrole-3-carboxylic acidorganooxygen compound |
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