| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:01 UTC |
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| Update Date | 2025-03-25 00:53:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201330 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H14O4 |
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| Molecular Mass | 210.0892 |
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| SMILES | COc1ccc(C(O)CC=O)cc1OC |
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| InChI Key | LDSFVOBIBFITQS-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-hydrogen aldehydesanisolesaromatic alcoholsbeta-hydroxy aldehydeshydrocarbon derivativesorganic oxidesphenoxy compoundssecondary alcohols |
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| Substituents | aromatic alcoholalcoholphenol etherbeta-hydroxy aldehydecarbonyl groupetheraldehydealkyl aryl etheraromatic homomonocyclic compounddimethoxybenzeneorganic oxideorganic oxygen compoundalpha-hydrogen aldehydeanisoleo-dimethoxybenzenesecondary alcoholhydrocarbon derivativephenoxy compoundorganooxygen compound |
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