| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:20 UTC |
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| Update Date | 2025-03-25 00:46:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158731 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18O3 |
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| Molecular Mass | 222.1256 |
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| SMILES | OC1CCC(O)(Cc2ccccc2)CC1O |
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| InChI Key | KKXMSUPPGXGWGF-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 | cyclohexanols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | benzene and substituted derivativescyclitols and derivativeshydrocarbon derivativestertiary alcohols |
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| Substituents | monocyclic benzene moietycyclohexanolcyclitol or derivativescyclic alcoholaromatic homomonocyclic compoundtertiary alcoholhydrocarbon derivativebenzenoid |
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