Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:29:50 UTC |
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Update Date | 2025-03-21 18:41:20 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00133709 |
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Frequency | 18.8 |
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Structure | |
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Chemical Formula | C10H12O4 |
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Molecular Mass | 196.0736 |
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SMILES | COc1ccc(C(O)C=O)cc1OC |
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InChI Key | DNRBCQHZHJFLGT-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 ethersalpha-hydroxyaldehydesanisolesaromatic alcoholshydrocarbon derivativesorganic oxidesphenoxy compoundsphenylacetaldehydessecondary alcohols |
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Substituents | aromatic alcoholalcoholphenol ethercarbonyl groupetheraldehydealkyl aryl etheraromatic homomonocyclic compounddimethoxybenzeneorganic oxidealpha-hydroxyaldehydeorganic oxygen compoundanisoleo-dimethoxybenzenesecondary alcoholhydrocarbon derivativephenoxy compoundorganooxygen compoundphenylacetaldehyde |
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