| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:16:15 UTC |
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| Update Date | 2025-03-21 18:34:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00101103 |
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| Frequency | 27.0 |
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| Structure | |
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| Chemical Formula | C20H22N2O3 |
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| Molecular Mass | 338.163 |
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| SMILES | C=CC1(O)CN2CCC1CC2C(=O)c1ccnc2ccc(OC)cc12 |
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| InChI Key | CYFWNPQIZWSTIX-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 | quinolines and derivatives |
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| Subclass | quinolines and derivatives |
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| Direct Parent | quinolines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesalkyl aryl ethersalpha-amino ketonesanisolesaryl alkyl ketonesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesorganic oxidesorganopnictogen compoundspiperidinespolyhalopyridinesquinuclidinestertiary alcoholstrialkylamines |
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| Substituents | phenol etheretheraryl alkyl ketonepolyhalopyridinequinuclidinealkyl aryl etherketoneorganic oxidealpha-aminoketonearomatic heteropolycyclic compoundorganonitrogen compoundquinolineorganopnictogen compound2-halopyridinepiperidinetertiary aminealcoholazacycleheteroaromatic compoundtertiary aliphatic aminehydroxypyridinemethylpyridinetertiary alcoholpyridineorganic oxygen compoundanisolehydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compoundaryl ketone |
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