| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:50 UTC |
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| Update Date | 2025-03-25 00:56:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02219457 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H16O6 |
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| Molecular Mass | 292.0947 |
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| SMILES | COc1cc(C=CC2CC(=O)C(CC(=O)O)O2)ccc1O |
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| InChI Key | XUXOETKOUZBFRZ-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 heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolescarboxylic acidscyclic ketonesdialkyl ethersfuranoneshydrocarbon derivativesmethoxybenzenesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsphenoxy compoundstetrahydrofurans |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupethercarboxylic acidaromatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidmethoxyphenolcyclic ketonealkyl aryl ethercarboxylic acid derivativedialkyl etherketoneorganic oxideorganoheterocyclic compoundtetrahydrofuranmethoxybenzeneoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundanisolehydrocarbon derivativephenoxy compound3-furanoneorganooxygen compound |
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