| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:58 UTC |
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| Update Date | 2025-03-25 00:46:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02157925 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H14N2O7 |
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| Molecular Mass | 310.0801 |
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| SMILES | O=C(O)c1c[nH]c2c1c(=O)ccn2C1OC(CO)C(O)C1O |
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| InChI Key | OQNNGMQPRNNJLW-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 | pyrrolopyridines |
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| Subclass | pyrrolopyridines |
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| Direct Parent | pyrrolopyridines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compounds2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridinesprimary alcoholspyrrole carboxylic acidssecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | carboxylic acidpyrrole-3-carboxylic acid or derivativespolyhalopyridinemonosaccharidecarboxylic acid derivativesaccharideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compound2-halopyridineprimary alcoholalcoholvinylogous amideazacyclepyrrolopyridinetetrahydrofuranheteroaromatic compoundhydroxypyridineoxacyclemonocarboxylic acid or derivativespyridineorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundpyrrole-3-carboxylic acidorganooxygen compound |
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