| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:26 UTC |
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| Update Date | 2025-03-25 00:59:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02236571 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H20N2O3 |
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| Molecular Mass | 312.1474 |
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| SMILES | COc1ccc2nccc(C3C(C(=O)O)CN4CCCC34)c2c1 |
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| InChI Key | HGRCEDWVJMAMJV-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 ethersamino acidsanisolesazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesmonocarboxylic acids and derivativesn-alkylpyrrolidinesorganic oxidesorganopnictogen compoundspolyhalopyridinespyrrolidine carboxylic acidspyrrolizidinestrialkylamines |
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| Substituents | phenol ethercarbonyl groupethercarboxylic acidamino acid or derivativesamino acidpolyhalopyridinealkyl aryl ethercarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundpyrrolidine carboxylic acidorganonitrogen compoundquinolineorganopnictogen compound2-halopyridinepyrrolidinetertiary amineazacyclen-alkylpyrrolidineheteroaromatic compoundtertiary aliphatic aminehydroxypyridinemethylpyridinemonocarboxylic acid or derivativespyrrolidine carboxylic acid or derivativespyridineorganic oxygen compoundanisolehydrocarbon derivativebenzenoidpyrrolizidineorganic nitrogen compoundamineorganooxygen compound |
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