| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:12 UTC |
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| Update Date | 2025-03-25 00:46:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153986 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H18O3 |
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| Molecular Mass | 210.1256 |
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| SMILES | COc1cccc(CC(O)C(C)(C)O)c1 |
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| InChI Key | SEQSHVLFMFITOZ-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 ethershydrocarbon derivativesmethoxybenzenesphenoxy compoundssecondary alcoholstertiary alcohols |
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| Substituents | alcoholmonocyclic benzene moietyetheralkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundtertiary alcoholorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativephenoxy compoundorganooxygen compound1,2-diol |
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