| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:11 UTC |
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| Update Date | 2025-03-25 00:46:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153920 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C28H24NO3+ |
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| Molecular Mass | 422.1751 |
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| SMILES | COc1ccc2ccc3cc4c(cc3c2c1)CC[n+]1cc2c(OC)c(OC)ccc2cc1-4 |
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| InChI Key | MXQZLZCCEPLVJS-UHFFFAOYSA-N |
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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 | 2-halopyridinesalkyl aryl ethersanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesisoquinolines and derivativesmethylpyridinesnaphthalenesorganic cationsorganonitrogen compoundsorganopnictogen compoundsphenanthrenes and derivativespolyhalopyridinesquinolizines |
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| Substituents | tetrahydroprotoberberine skeletonphenol etheretherpolyhalopyridinealkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineorganic cationorganoheterocyclic compoundquinolizinephenanthreneazacycleheteroaromatic compoundmethylpyridineprotoberberine skeletonpyridinenaphthaleneorganic oxygen compoundanisoleisoquinolinehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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