Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:19:41 UTC |
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Update Date | 2025-03-21 18:36:14 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00109591 |
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Frequency | 24.4 |
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Structure | |
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Chemical Formula | C17H18O5 |
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Molecular Mass | 302.1154 |
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SMILES | COc1ccc(CC2COc3cc(OC)c(O)cc32)cc1O |
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InChI Key | RKEDALPAVGMPSY-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 ethersanisolescoumaranshydrocarbon derivativesmethoxybenzenesoxacyclic compoundsphenoxy compounds |
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Substituents | phenol ethermonocyclic benzene moietyether1-hydroxy-2-unsubstituted benzenoidmethoxyphenol1-hydroxy-4-unsubstituted benzenoidalkyl aryl ethermethoxybenzeneoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundanisolehydrocarbon derivativephenoxy compoundorganoheterocyclic compoundcoumaranorganooxygen compound |
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