| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 17:15:31 UTC |
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| Update Date | 2025-03-25 01:46:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02515360 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H6N2O2 |
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| Molecular Mass | 138.0429 |
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| SMILES | O=NC(O)c1cccnc1 |
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| InChI Key | IRODIGCODMEJTN-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 | alkanolaminesaromatic alcoholsazacyclic compoundsc-nitroso compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganic oxidesorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | aromatic alcoholorganic nitroso compoundaromatic heteromonocyclic compoundazacyclenicotinamideheteroaromatic compoundhydroxypyridineorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundc-nitroso compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundalkanolamine |
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