Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:15 UTC |
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Update Date | 2025-03-21 18:35:02 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00103627 |
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Frequency | 26.2 |
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Structure | |
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Chemical Formula | C9H8N2O2 |
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Molecular Mass | 176.0586 |
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SMILES | Nc1cccc2c(C(=O)O)c[nH]c12 |
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InChI Key | OSUSBMTWPNEQLJ-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 compoundsamino acidsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesindolesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespyrrole carboxylic acidsvinylogous amides |
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Substituents | carboxylic acidpyrrole-3-carboxylic acid or derivativesamino acid or derivativesamino acidindolecarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compoundindolecarboxylic acid derivativevinylogous amideazacycleheteroaromatic compoundmonocarboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundpyrrole-3-carboxylic acidamineorganooxygen compound |
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