| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:09 UTC |
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| Update Date | 2025-03-21 18:32:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00091156 |
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| Frequency | 30.8 |
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| Structure | |
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| Chemical Formula | C12H16O3 |
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| Molecular Mass | 208.1099 |
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| SMILES | CC(C)(C)c1cc(C=O)cc(CO)c1O |
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| InChI Key | DZXNENOZPHYESI-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 | phenylpropanes |
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| Direct Parent | phenylpropanes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aromatic alcoholsbenzoyl derivativesbenzyl alcoholshydrocarbon derivativeshydroxybenzaldehydesorganic oxidesphenols |
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| Substituents | aromatic alcoholalcoholbenzoylaldehydebenzyl alcoholphenylpropanearomatic homomonocyclic compoundbenzaldehydeorganic oxidearyl-aldehydeorganic oxygen compoundphenolhydrocarbon derivativehydroxybenzaldehydeorganooxygen compound |
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