Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:37:01 UTC |
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Update Date | 2025-03-21 17:57:32 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00008512 |
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Frequency | 575.1 |
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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 | COc1cc(C=O)cc(OC)c1OC |
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InChI Key | OPHQOIGEOHXOGX-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 | phenol ethers |
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Subclass | anisoles |
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Direct Parent | anisoles |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | alkyl aryl ethersbenzaldehydesbenzoyl derivativeshydrocarbon derivativesmethoxybenzenesorganic oxidesphenoxy compounds |
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Substituents | monocyclic benzene moietyetherbenzoylaldehydealkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundbenzaldehydeorganic oxidearyl-aldehydeorganic oxygen compoundanisolehydrocarbon derivativephenoxy compoundorganooxygen compound |
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