| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:33 UTC |
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| Update Date | 2025-03-21 18:29:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00077919 |
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| Frequency | 37.6 |
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| Structure | |
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| Chemical Formula | C20H20NO4+ |
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| Molecular Mass | 338.1387 |
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| SMILES | COc1cc2c(cc1O)-c1cc3ccc(OC)c(OC)c3c[n+]1CC2 |
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| InChI Key | YYFOFDHQVIODOQ-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | alkaloids and derivatives |
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| Class | protoberberine alkaloids and derivatives |
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| Subclass | protoberberine alkaloids and derivatives |
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| Direct Parent | protoberberine alkaloids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesalkyl aryl ethersanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesisoquinolines and derivativesmethylpyridinesorganic cationsorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinesquinolizines |
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| Substituents | tetrahydroprotoberberine skeletonphenol etheretherpolyhalopyridine1-hydroxy-2-unsubstituted benzenoidalkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineorganic cationorganoheterocyclic compoundquinolizineazacycleheteroaromatic compoundhydroxypyridinemethylpyridineprotoberberine skeletonpyridineorganic oxygen compoundanisoleisoquinolinehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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