| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:49 UTC |
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| Update Date | 2025-03-21 18:02:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00038138 |
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| Frequency | 91.9 |
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| Structure | |
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| Chemical Formula | C11H16O |
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| Molecular Mass | 164.1201 |
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| SMILES | Cc1ccc(C(O)C(C)C)cc1 |
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| InChI Key | PKSSQQPDFFZHEU-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 alcoholstoluenes |
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| Substituents | aromatic alcoholphenylpropanealcoholaromatic homomonocyclic compoundorganic oxygen compoundsecondary alcoholhydrocarbon derivativetolueneorganooxygen compound |
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