| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:41:36 UTC |
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| Update Date | 2025-03-21 17:59:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00018882 |
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| Frequency | 218.2 |
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| Structure | |
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| Chemical Formula | C8H12O2 |
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| Molecular Mass | 140.0837 |
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| SMILES | CC1=CC(=O)CC(C)(C)O1 |
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| InChI Key | ZCHCAGXPCLIZMW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | pyrans |
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| Subclass | pyranones and derivatives |
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| Direct Parent | dihydropyranones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | cyclic ketoneshydrocarbon derivativesorganic oxidesoxacyclic compoundsvinylogous esters |
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| Substituents | carbonyl groupdihydropyranonevinylogous estercyclic ketoneketoneoxacycleorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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