| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:37 UTC |
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| Update Date | 2025-03-25 00:56:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02218942 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16O5 |
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| Molecular Mass | 240.0998 |
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| SMILES | COc1ccc(CCC(=O)OCO)cc1OC |
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| InChI Key | GVIMAMYTCSOUAP-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 | benzene and substituted derivatives |
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| Subclass | methoxybenzenes |
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| Direct Parent | dimethoxybenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolescarbonyl compoundscarboxylic acid estersfatty acid estershemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesphenoxy compounds |
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| Substituents | fatty acylphenol ethercarbonyl groupetheralkyl aryl ethercarboxylic acid derivativearomatic homomonocyclic compounddimethoxybenzenefatty acid esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundanisoleo-dimethoxybenzenecarboxylic acid esterhemiacetalhydrocarbon derivativephenoxy compoundorganooxygen compound |
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