| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:41 UTC |
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| Update Date | 2025-03-25 00:59:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02234891 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H10N2O7P+ |
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| Molecular Mass | 265.022 |
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| SMILES | Cc1ncc(COP(=O)(O)O)c([N+](=O)O)c1O |
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| InChI Key | FQSAJZBHAUIDJE-UHFFFAOYSA-O |
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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 | halopyridines |
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| Direct Parent | polyhalopyridines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonoalkyl phosphatesnitroaromatic compoundsorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | aromatic heteromonocyclic compoundpolyhalopyridineallyl-type 1,3-dipolar organic compoundorganic nitro compoundpropargyl-type 1,3-dipolar organic compoundorganic oxidec-nitro compoundorganonitrogen compoundorganopnictogen compound2-halopyridineorganic oxoazaniumnitroaromatic compoundazacycleheteroaromatic compoundhydroxypyridineorganic 1,3-dipolar compoundorganic oxygen compoundphosphoric acid estermonoalkyl phosphatehydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compoundorganic hyponitrite |
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