| Record Information | 
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| HMDB Status | Not Available | 
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| Creation Date | 2024-02-21 14:57:27 UTC | 
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| Update Date | 2025-03-25 00:52:41 UTC | 
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| HMDB ID | Not Available | 
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| Metabolite Identification | 
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| DeepMet ID | DMID02195387 | 
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| Frequency | 0.5 | 
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| Structure |  | 
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| Chemical Formula | C9H12O | 
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| Molecular Mass | 136.0888 | 
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| SMILES | CC1=CCCCC1=CC=O | 
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| InChI Key | ATFNGVWSEWTGMN-UHFFFAOYSA-N | 
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| Chemical Taxonomy | 
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| Kingdom | organic compounds | 
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| Superclass | hydrocarbon derivatives | 
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| Class | Not Available | 
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| Subclass  | hydrocarbon derivatives | 
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| Direct Parent  | hydrocarbon derivatives | 
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| Geometric Descriptor  | aliphatic homomonocyclic compounds | 
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| Alternative Parents  | aldehydesorganic oxides | 
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| Substituents  | carbonyl grouporganic oxideorganic oxygen compoundaliphatic homomonocyclic compoundaldehydehydrocarbon derivativeorganooxygen compound | 
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