| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:59 UTC |
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| Update Date | 2025-03-21 18:35:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00107896 |
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| Frequency | 24.9 |
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| Structure | |
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| Chemical Formula | C15H14O4 |
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| Molecular Mass | 258.0892 |
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| SMILES | Oc1ccc2c(c1)OCC2Cc1ccc(O)c(O)c1 |
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| InChI Key | QKNBTTUYDXMIRE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | coumarans |
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| Subclass | coumarans |
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| Direct Parent | coumarans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersbenzene and substituted derivativeshydrocarbon derivativesoxacyclic compounds |
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| Substituents | monocyclic benzene moietyether1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalkyl aryl etheroxacycleorganic oxygen compoundaromatic heteropolycyclic compoundphenolhydrocarbon derivativebenzenoidcoumaranorganooxygen compound |
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