| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:57 UTC |
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| Update Date | 2025-03-21 18:02:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00038463 |
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| Frequency | 91.0 |
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| Structure | |
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| Chemical Formula | C12H18O2 |
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| Molecular Mass | 194.1307 |
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| SMILES | CC(O)c1ccc(CC(C)(C)O)cc1 |
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| InChI Key | QRHURGVOBUKUGQ-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 alcoholshydrocarbon derivativessecondary alcoholstertiary alcohols |
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| Substituents | aromatic alcoholphenylpropanealcoholaromatic homomonocyclic compoundtertiary alcoholorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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