| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:31 UTC |
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| Update Date | 2025-03-25 00:54:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02204714 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H16O4 |
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| Molecular Mass | 284.1049 |
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| SMILES | O=CC(Cc1cccc(O)c1)C(=O)Cc1cccc(O)c1 |
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| InChI Key | KOPWZIATCRFYHT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lignans, neolignans and related compounds |
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| Class | Not Available |
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| Subclass | lignans, neolignans and related compounds |
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| Direct Parent | lignans, neolignans and related compounds |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativesbeta ketoaldehydeshydrocarbon derivativesketonesorganic oxides |
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| Substituents | monocyclic benzene moietycarbonyl groupbeta-ketoaldehyde1-hydroxy-2-unsubstituted benzenoidaldehydenorlignan skeleton1-hydroxy-4-unsubstituted benzenoidketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundphenolhydrocarbon derivativebenzenoid1,3-dicarbonyl compoundorganooxygen compound |
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