| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:08 UTC |
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| Update Date | 2025-03-25 00:54:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02203843 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H12NO3+ |
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| Molecular Mass | 194.0812 |
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| SMILES | OC1CC[n+]2cc3c(cc2C1)OCO3 |
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| InChI Key | FDSJXAFWMBCHTR-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 | quinolizines |
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| Subclass | quinolizines |
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| Direct Parent | quinolizines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesacetalsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganic cationsorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridinessecondary alcohols |
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| Substituents | alcoholazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridineoxacyclepyridineorganic oxygen compoundacetalaromatic heteropolycyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganic cationorganooxygen compoundquinolizine |
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