| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:49 UTC |
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| Update Date | 2025-03-25 00:59:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02237423 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H18N2O3 |
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| Molecular Mass | 286.1317 |
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| SMILES | Nc1ccc(O)cc1C(=O)CC(N)Cc1ccc(O)cc1 |
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| InChI Key | IQBMJNHDLVNCBD-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lignans, neolignans and related compounds |
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| Class | Not Available |
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| Subclass | lignans, neolignans and related compounds |
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| Direct Parent | lignans, neolignans and related compounds |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl-phenylketonesamphetamines and derivativesaryl alkyl ketonesbenzoyl derivativesbutyrophenoneshydrocarbon derivativesmonoalkylaminesorganic oxidesorganooxygen compoundsorganopnictogen compoundsvinylogous amides |
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| Substituents | monocyclic benzene moietyaryl alkyl ketonebenzoyl1-hydroxy-2-unsubstituted benzenoidnorlignan skeletonketoneorganic oxideorganonitrogen compoundorganopnictogen compoundamphetamine or derivativesvinylogous amidephenylketonebutyrophenonearomatic homomonocyclic compoundorganic oxygen compoundphenolhydrocarbon derivativebenzenoidprimary aliphatic amineprimary amineorganic nitrogen compoundaminealkyl-phenylketoneorganooxygen compoundaryl ketone |
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