| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:10 UTC |
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| Update Date | 2025-03-25 00:48:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02169665 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16O4 |
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| Molecular Mass | 224.1049 |
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| SMILES | CCc1ccc(C2OC(O)C(CO)O2)cc1 |
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| InChI Key | KUBAGNWIVOKUFE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,3-dioxolanesacetalshemiacetalshydrocarbon derivativesoxacyclic compoundsprimary alcohols |
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| Substituents | alcoholmonocyclic benzene moietymeta-dioxolanearomatic heteromonocyclic compoundoxacycleorganic oxygen compoundacetalhemiacetalhydrocarbon derivativeprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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