| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:33 UTC |
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| Update Date | 2025-03-21 18:29:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00080365 |
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| Frequency | 36.2 |
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| Structure | |
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| Chemical Formula | C7H7N3O3 |
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| Molecular Mass | 181.0487 |
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| SMILES | NC(=O)c1cc(C(=O)O)cnc1N |
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| InChI Key | YPRPFDZOGDPDCN-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 | pyridines and derivatives |
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| Subclass | pyridinecarboxylic acids and derivatives |
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| Direct Parent | nicotinamides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesamino acidsazacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesimidolactamsmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundspolyhalopyridinesprimary aminesprimary carboxylic acid amidespyridine-3-carboxylic acidsvinylogous amides |
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| Substituents | primary carboxylic acid amidecarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidpyridine-3-carboxylic acidpolyhalopyridinenicotinamidecarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compound2-halopyridineimidolactamvinylogous amideazacycleheteroaromatic compoundhydroxypyridinecarboxamide groupmonocarboxylic acid or derivativesorganic oxygen compoundpyridine carboxylic acidhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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