| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:00:39 UTC |
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| Update Date | 2025-03-21 18:06:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00063697 |
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| Frequency | 48.4 |
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| Structure | |
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| Chemical Formula | C12H16O4 |
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| Molecular Mass | 224.1049 |
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| SMILES | COC(=O)CCc1ccc(OC)c(OC)c1 |
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| InChI Key | VSWFXSSYWWNFNF-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 compoundsfatty acid estershydrocarbon derivativesmethyl estersmonocarboxylic 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 derivativesmethyl esterorganic oxygen compoundanisoleo-dimethoxybenzenecarboxylic acid esterhydrocarbon derivativephenoxy compoundorganooxygen compound |
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