| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:28 UTC |
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| Update Date | 2025-03-25 00:46:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154617 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H16O7 |
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| Molecular Mass | 344.0896 |
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| SMILES | COc1ccc(C2OC(CC(=O)O)c3cc4c(cc32)OCO4)cc1O |
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| InChI Key | PPKDBACDYLEWAN-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 benzenoidsacetalsalkyl aryl ethersanisolesbenzodioxolescarbonyl compoundscarboxylic acidsdialkyl ethershydrocarbon derivativesisocoumaransmethoxybenzenesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsphenoxy compounds |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupethercarboxylic acid1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl ethercarboxylic acid derivativedialkyl etherorganic oxideisocoumaranacetalaromatic heteropolycyclic compoundorganoheterocyclic compoundbenzodioxole1-hydroxy-4-unsubstituted benzenoidmethoxybenzeneoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundanisolehydrocarbon derivativephenoxy compoundorganooxygen compound |
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