| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:35:36 UTC |
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| Update Date | 2025-03-21 17:57:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00005238 |
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| Frequency | 1028.8 |
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| Structure | |
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| Chemical Formula | C9H12O3 |
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| Molecular Mass | 168.0786 |
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| SMILES | COc1cccc(C(O)CO)c1 |
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| InChI Key | BEELBVBCHQSTKQ-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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