| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:57 UTC |
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| Update Date | 2025-03-21 18:29:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00078909 |
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| Frequency | 37.0 |
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| Structure | |
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| Chemical Formula | C12H16 |
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| Molecular Mass | 160.1252 |
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| SMILES | C=CC(C)(C)c1ccc(C)cc1 |
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| InChI Key | JJQMPJOQURDGRS-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 | cyclic olefinstoluenesunsaturated aliphatic hydrocarbons |
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| Substituents | phenylpropanearomatic homomonocyclic compoundcyclic olefinunsaturated aliphatic hydrocarbonolefintoluenehydrocarbonunsaturated hydrocarbon |
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