| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:57 UTC |
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| Update Date | 2025-03-25 00:46:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02155732 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H11NO2 |
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| Molecular Mass | 177.079 |
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| SMILES | CC(=O)C=CNc1ccccc1O |
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| InChI Key | DBKZCTMDAFJAPR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | secondary alkylarylamines |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsacryloyl compoundsbenzene and substituted derivativesenoneshydrocarbon derivativesketonesorganic oxidesorganopnictogen compoundsvinylogous amides |
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| Substituents | vinylogous amidemonocyclic benzene moietycarbonyl group1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalpha,beta-unsaturated ketonesecondary aliphatic/aromatic amineketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundorganopnictogen compoundphenolhydrocarbon derivativebenzenoidacryloyl-grouporganooxygen compoundenone |
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