| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:50 UTC |
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| Update Date | 2025-03-25 01:01:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02251344 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18O5 |
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| Molecular Mass | 254.1154 |
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| SMILES | Oc1ccc(C(O)C2CCC(O)CC2O)cc1O |
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| InChI Key | RQKQELSQRNLSIZ-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 | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaromatic alcoholsbenzene and substituted derivativescyclic alcohols and derivativeshydrocarbon derivatives |
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| Substituents | aromatic alcoholmonocyclic benzene moietycyclohexanol1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidcyclic alcoholaromatic homomonocyclic compoundphenolhydrocarbon derivativebenzenoid |
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