| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:56 UTC |
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| Update Date | 2025-03-25 00:59:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235500 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H20N2O3 |
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| Molecular Mass | 324.1474 |
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| SMILES | COc1cc(CC(=O)NCCc2c[nH]c3ccccc23)ccc1O |
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| InChI Key | VQHUBLIKYBKAQM-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenols |
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| Subclass | methoxyphenols |
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| Direct Parent | methoxyphenols |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesindolesmethoxybenzenesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsphenoxy compoundsphenylacetamidespyrrolessecondary carboxylic acid amides |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupetherindole1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl ethercarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundphenylacetamideorganoheterocyclic compoundazacycleheteroaromatic compoundindole or derivativescarboxamide groupmethoxybenzenesecondary carboxylic acid amideorganic oxygen compoundanisolepyrrolehydrocarbon derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compound |
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