| 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 | DMID02251343 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H14O5 |
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| Molecular Mass | 274.0841 |
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| SMILES | Oc1ccc(C(O)C2Cc3cc(O)cc(O)c3O2)cc1 |
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| InChI Key | XWKQLWCPHGQKNH-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 ethersaromatic alcoholsbenzene and substituted derivativeshydrocarbon derivativesoxacyclic compoundssecondary alcohols |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moietyether1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalkyl aryl etheroxacycleorganic oxygen compoundaromatic heteropolycyclic compoundsecondary alcoholphenolhydrocarbon derivativebenzenoidcoumaranorganooxygen compound |
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