| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:53:36 UTC |
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| Update Date | 2025-03-21 18:03:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00047217 |
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| Frequency | 70.6 |
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| Structure | |
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| Chemical Formula | C17H18O6 |
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| Molecular Mass | 318.1103 |
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| SMILES | COc1cc(CC2Oc3cc(O)cc(O)c3CC2O)ccc1O |
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| InChI Key | NGYJISBNDIEAEO-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-benzopyrans1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisoleshydrocarbon derivativesmethoxybenzenesoxacyclic compoundsphenoxy compoundssecondary alcohols |
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| Substituents | alcoholphenol ethermonocyclic benzene moietyetherbenzopyran1-benzopyran1-hydroxy-2-unsubstituted benzenoidmethoxyphenol1-hydroxy-4-unsubstituted benzenoidalkyl aryl ethermethoxybenzeneoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundanisolesecondary alcoholchromanehydrocarbon derivativephenoxy compoundorganoheterocyclic compoundorganooxygen compound |
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