| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:47 UTC |
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| Update Date | 2025-03-25 00:48:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02171091 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H14NO5+ |
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| Molecular Mass | 300.0866 |
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| SMILES | COc1c[n+]2c(c3c1OCO3)-c1cc3c(cc1CC2)OCO3 |
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| InChI Key | GSNVUUOEJOLTIP-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-halopyridinesacetalsalkyl aryl ethersazacyclic compoundsbenzenoidsbenzodioxolesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganic cationsorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridines |
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| Substituents | etherazacyclepolyhalopyridineheteroaromatic compoundmethylpyridinealkyl aryl etheroxacyclepyridineorganic oxygen compoundacetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundorganic cationorganooxygen compoundbenzodioxolequinolizine |
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