| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:18 UTC |
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| Update Date | 2025-03-25 00:55:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213618 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H16O5 |
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| Molecular Mass | 264.0998 |
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| SMILES | COC(=O)C1=CCC(c2ccc(O)c(OC)c2)OC1 |
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| InChI Key | PZKIQWVPERELNR-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 ethersanisolescarbonyl compoundsdialkyl ethersenoate estershydrocarbon derivativesmethoxybenzenesmethyl estersmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsphenoxy compoundspyran carboxylic acids |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupetheraromatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl ethercarboxylic acid derivativepyran carboxylic aciddialkyl etheralpha,beta-unsaturated carboxylic esterorganic oxidemethyl esterorganoheterocyclic compoundenoate esterpyran carboxylic acid or derivativesmethoxybenzeneoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundpyrananisolecarboxylic acid esterhydrocarbon derivativephenoxy compoundorganooxygen compound |
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