| 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 | DMID02200361 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H19NO8 |
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| Molecular Mass | 329.1111 |
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| SMILES | Cc1ncc(COCC2OC(O)C(O)C(O)C2O)c(C=O)c1O |
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| InChI Key | WSHSKNBKQJTZEP-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 | pyridine carboxaldehydes |
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| Direct Parent | pyridoxals and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesaryl-aldehydesazacyclic compoundsdialkyl ethershemiacetalsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanespolyhalopyridinespyridinecarboxylic acids and derivativessecondary alcoholsvinylogous acids |
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| Substituents | pyridine carboxylic acid or derivativesetheraromatic heteromonocyclic compoundpolyhalopyridinemonosaccharidedialkyl ethersaccharideorganic oxidearyl-aldehydeorganonitrogen compoundorganopnictogen compoundhemiacetal2-halopyridineoxanealcoholpyridoxalazacycleheteroaromatic compoundhydroxypyridinealdehydeoxacyclevinylogous acidorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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