| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:59 UTC |
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| Update Date | 2025-03-25 00:54:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02205783 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H17N3O2 |
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| Molecular Mass | 259.1321 |
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| SMILES | NCCCCNc1ccnc2cc(C(=O)O)ccc12 |
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| InChI Key | BBZHQOQELKRVFN-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 | quinoline carboxylic acids |
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| Direct Parent | quinoline carboxylic acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesamino acidsazacyclic compoundsbenzenoidscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundspolyhalopyridinessecondary alkylarylamines |
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| Substituents | carboxylic acidamino acid or derivativesamino acidpolyhalopyridinecarboxylic acid derivativeorganic oxidequinoline-7-carboxylic acidaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineazacycleheteroaromatic compoundhydroxypyridinesecondary aminesecondary aliphatic/aromatic aminemonocarboxylic acid or derivativespyridineorganic oxygen compoundhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundamineorganooxygen compound |
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