| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:57 UTC |
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| Update Date | 2025-03-25 00:46:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02157873 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H8N2O5 |
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| Molecular Mass | 260.0433 |
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| SMILES | O=C(O)c1[nH]c2c([nH]c3cc(O)ccc32)c(=O)c1O |
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| InChI Key | MFVSNCUTCYPJDV-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 | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesazacyclic compoundsbenzenoidscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridine-2-carboxylic acidspyrrolesvinylogous acidsvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativescarboxylic acidindolepolyhalopyridine1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativeorganic oxidepyridine-2-carboxylic acidaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinevinylogous amideazacycleheteroaromatic compoundhydroxypyridinevinylogous acidmonocarboxylic acid or derivativespyridineorganic oxygen compoundpyrrolepyridine carboxylic acidhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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