| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:20 UTC |
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| Update Date | 2025-03-25 00:46:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154308 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18O6 |
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| Molecular Mass | 270.1103 |
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| SMILES | COc1cc(C=CC(O)C(O)CO)cc(OC)c1O |
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| InChI Key | KXTRGAQYMRJASI-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 | alkyl aryl ethersanisolescinnamyl alcoholsdimethoxybenzenesfatty alcoholshydrocarbon derivativesphenoxy compoundsprimary alcoholssecondary alcohols |
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| Substituents | alcoholfatty acylphenol ethermonocyclic benzene moietyethermethoxyphenolcinnamyl alcoholalkyl aryl ethermethoxybenzenearomatic homomonocyclic compounddimethoxybenzeneorganic oxygen compoundfatty alcoholm-dimethoxybenzeneanisolesecondary alcoholhydrocarbon derivativephenoxy compoundprimary alcoholorganooxygen compound |
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