| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:02:05 UTC |
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| Update Date | 2025-03-21 18:07:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00067139 |
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| Frequency | 45.3 |
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| Structure | |
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| Chemical Formula | C12H18 |
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| Molecular Mass | 162.1409 |
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| SMILES | Cc1ccc(CC(C)C)cc1C |
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| InChI Key | DAJXLGNVRKXFRB-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 | saturated hydrocarbonso-xylenes |
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| Substituents | phenylpropanearomatic homomonocyclic compoundxylenesaturated hydrocarbono-xylenehydrocarbon |
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