| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:45 UTC |
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| Update Date | 2025-03-25 00:46:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02152890 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H13N3O3 |
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| Molecular Mass | 223.0957 |
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| SMILES | NC(=O)NCCC(=O)c1ccc(O)cc1N |
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| InChI Key | NFBWSTVYWBWDRF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | alkyl-phenylketones |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaryl alkyl ketonesbenzoyl derivativeshydrocarbon derivativesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsprimary aminesvinylogous amides |
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| Substituents | vinylogous amidemonocyclic benzene moietycarbonic acid derivativearyl alkyl ketonebenzoyl1-hydroxy-2-unsubstituted benzenoidaromatic homomonocyclic compoundorganic oxideorganonitrogen compoundorganopnictogen compoundphenolhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundaminealkyl-phenylketone |
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