| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:45:19 UTC |
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| Update Date | 2025-03-25 00:48:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02167780 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H18N2O3 |
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| Molecular Mass | 226.1317 |
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| SMILES | CC(C)NCC(O)Cn1ccc(O)cc1=O |
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| InChI Key | GJVJVZAARMSRSK-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 | pyridines and derivatives |
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| Subclass | hydropyridines |
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| Direct Parent | pyridinones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkylaminesheteroaromatic compoundshydrocarbon derivativeshydroxypyridineslactamsmethylpyridinesorganic oxidesorganopnictogen compoundssecondary alcoholsvinylogous acids |
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| Substituents | alcoholsecondary aliphatic aminelactamaromatic heteromonocyclic compoundazacycleheteroaromatic compoundhydroxypyridinemethylpyridinesecondary aminevinylogous acidorganic oxideorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyridinoneorganooxygen compoundamine |
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