Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:39:35 UTC |
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Update Date | 2025-03-21 17:58:27 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00014479 |
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Frequency | 304.3 |
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Structure | |
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Chemical Formula | C11H16O5 |
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Molecular Mass | 228.0998 |
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SMILES | COc1cc(C(O)CO)cc(OC)c1OC |
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InChI Key | VRYUDXCGWXDNLR-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 | 1,2-diolsalkyl aryl ethersaromatic alcoholshydrocarbon derivativesmethoxybenzenesphenoxy compoundsprimary alcoholssecondary alcohols |
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Substituents | aromatic alcoholalcoholmonocyclic benzene moietyetheralkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativephenoxy compoundprimary alcoholorganooxygen compound1,2-diol |
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