| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:47:13 UTC |
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| Update Date | 2025-03-24 20:53:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01602839 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C9H16O |
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| Molecular Mass | 140.1201 |
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| SMILES | CC1=CC(O)(C(C)C)CC1 |
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| InChI Key | LUXDYWQUTRDWLJ-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 | alcohols and polyols |
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| Direct Parent | tertiary alcohols |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | hydrocarbon derivatives |
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| Substituents | tertiary alcoholaliphatic homomonocyclic compoundhydrocarbon derivative |
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