| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:28 UTC |
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| Update Date | 2025-03-25 00:46:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154610 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H13NO4 |
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| Molecular Mass | 271.0845 |
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| SMILES | COc1ccc(C2Nc3cc(O)ccc3C2=O)cc1O |
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| InChI Key | YSXKGXCMGOAYGG-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 benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisolesaryl alkyl ketonesazacyclic compoundshydrocarbon derivativesindolesindolinesmethoxybenzenesorganic oxidesorganopnictogen compoundsphenoxy compoundssecondary alkylarylaminesvinylogous amides |
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| Substituents | phenol ethermonocyclic benzene moietyetheraryl alkyl ketoneindole1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etherketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compounddihydroindoleorganoheterocyclic compoundvinylogous amideazacycleindole or derivatives1-hydroxy-4-unsubstituted benzenoidsecondary aminemethoxybenzenesecondary aliphatic/aromatic amineorganic oxygen compoundanisolehydrocarbon derivativeorganic nitrogen compoundphenoxy compoundamineorganooxygen compoundaryl ketone |
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