| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:16 UTC |
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| Update Date | 2025-03-25 00:45:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02149420 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H21N3O6 |
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| Molecular Mass | 375.143 |
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| SMILES | NC(=O)c1c(NCc2ccccc2)ccn(C2OC(CO)C(O)C2O)c1=O |
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| InChI Key | FEEYSQQJOTWXKR-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 | pyridinecarboxylic acids and derivatives |
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| Direct Parent | pyridinecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundsbenzene and substituted derivativescarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeshydroxypyridineslactamsmonosaccharidesnicotinamidesorganic oxidesorganopnictogen compoundsoxacyclic compoundspolyhalopyridinesprimary alcoholsprimary carboxylic acid amidespyridinonessecondary alcoholssecondary alkylarylaminestetrahydrofuransvinylogous amides |
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| Substituents | primary carboxylic acid amidepyridine carboxylic acid or derivativesmonocyclic benzene moietylactamaromatic heteromonocyclic compoundamino acid or derivativespolyhalopyridinenicotinamidemonosaccharidecarboxylic acid derivativesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundprimary alcoholalcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundhydroxypyridinesecondary aminecarboxamide groupsecondary aliphatic/aromatic amineoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneamineorganooxygen compound |
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