| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-21 00:03:36 UTC |
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| Update Date | 2025-03-21 18:28:15 UTC |
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| HMDB ID | HMDB0035228 |
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| Metabolite Identification |
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| DeepMet ID | DMID00070764 |
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| Name | Theaspirone A |
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| Frequency | 42.5 |
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| Structure | |
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| Chemical Formula | C13H20O2 |
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| Molecular Mass | 208.1463 |
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| SMILES | CC1=CC(=O)CC(C)(C)C12CCC(C)O2 |
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| InChI Key | AXQMCYYCOKLZPP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | cyclohexenones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | dialkyl ethershydrocarbon derivativesorganic oxidesoxacyclic compoundstetrahydrofurans |
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| Substituents | cyclohexenoneethertetrahydrofurandialkyl etheroxacycleorganic oxidealiphatic heteromonocyclic compoundhydrocarbon derivativeorganoheterocyclic compound |
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