Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:29:57 UTC |
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Update Date | 2025-03-21 18:41:22 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00133957 |
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Frequency | 18.8 |
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Structure | |
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Chemical Formula | C11H16O4 |
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Molecular Mass | 212.1049 |
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SMILES | COc1ccc(CC(CO)CO)cc1O |
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InChI Key | NZLHVGNDOKXUKM-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 benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisoleshydrocarbon derivativesmethoxybenzenesphenoxy compoundsprimary alcohols |
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Substituents | alcoholphenol ethermonocyclic benzene moietyether1-hydroxy-2-unsubstituted benzenoidmethoxyphenol1-hydroxy-4-unsubstituted benzenoidalkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundorganic oxygen compoundanisolehydrocarbon derivativephenoxy compoundprimary alcoholorganooxygen compound |
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