| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:36 UTC |
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| Update Date | 2025-03-25 00:53:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200349 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H20N2O6 |
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| Molecular Mass | 300.1321 |
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| SMILES | Cc1ncc(CNC2OC(CO)C(O)C(O)C2O)cc1O |
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| InChI Key | MNQUYWVGNHWIAD-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 | 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 compoundsdialkylamineshemiaminalsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonosaccharidesorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcohols |
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| Substituents | aromatic heteromonocyclic compoundpolyhalopyridinemonosaccharidehemiaminalsaccharideorganonitrogen compoundorganopnictogen compound2-halopyridineoxaneprimary alcoholalcoholsecondary aliphatic amineazacycleheteroaromatic compoundhydroxypyridinesecondary amineoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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