| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:40 UTC |
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| Update Date | 2025-03-21 18:02:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00037774 |
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| Frequency | 93.0 |
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| Structure | |
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| Chemical Formula | C12H14O |
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| Molecular Mass | 174.1045 |
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| SMILES | C=CC(=O)c1c(C)ccc(C)c1C |
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| InChI Key | BKLJCCJYTYWJNH-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 | benzoyl derivatives |
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| Direct Parent | benzoyl derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alpha,beta-unsaturated ketonesaryl ketoneshydrocarbon derivativesorganic oxidesorganooxygen compounds |
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| Substituents | ketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundbenzoylhydrocarbon derivativealpha,beta-unsaturated ketoneorganooxygen compoundaryl ketone |
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