| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:34 UTC |
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| Update Date | 2025-03-25 00:46:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02157052 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H12O4 |
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| Molecular Mass | 208.0736 |
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| SMILES | O=C1OCC(CCc2cccc(O)c2)O1 |
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| InChI Key | VOGLAZMYRMOZOV-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 | phenols |
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| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,3-dioxolanes1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativescarbonic acid diesterscarbonyl compoundshydrocarbon derivativesorganic oxidesoxacyclic compounds |
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| Substituents | monocyclic benzene moietymeta-dioxolanecarbonyl groupcarbonic acid derivativearomatic heteromonocyclic compoundcarbonic acid diester1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidoxacycleorganic oxideorganic oxygen compoundhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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