| Record Information |
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| HMDB Status | predicted |
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| Creation Date | 2024-02-21 00:04:55 UTC |
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| Update Date | 2025-03-21 18:28:47 UTC |
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| HMDB ID | HMDB0133478 |
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| Metabolite Identification |
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| DeepMet ID | DMID00073981 |
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| Name | 3-hydroxy-4-(4-hydroxy-3-methoxyphenyl)butan-2-one |
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| Frequency | 40.2 |
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| Structure | |
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| Chemical Formula | C11H14O4 |
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| Molecular Mass | 210.0892 |
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| SMILES | COc1cc(CC(O)C(C)=O)ccc1O |
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| InChI Key | SMSJXMDZTUDSNZ-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 homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsacyloinsalkyl aryl ethersalpha-hydroxy ketonesanisoleshydrocarbon derivativesmethoxybenzenesorganic oxidesphenoxy compoundssecondary alcohols |
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| Substituents | alcoholphenol ethermonocyclic benzene moietycarbonyl groupether1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etheralpha-hydroxy ketonemethoxybenzeneketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundanisoleacyloinsecondary alcoholhydrocarbon derivativephenoxy compoundorganooxygen compound |
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