| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:48 UTC |
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| Update Date | 2025-03-25 00:57:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224007 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H18O5 |
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| Molecular Mass | 326.1154 |
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| SMILES | O=C(CCc1ccc(O)cc1)CC(=O)CC(=O)c1ccccc1O |
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| InChI Key | QEZIVAPJRIUDGO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | diarylheptanoids |
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| Subclass | linear diarylheptanoids |
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| Direct Parent | linear diarylheptanoids |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl-phenylketonesaryl alkyl ketonesbenzoyl derivativesbutyrophenoneshydrocarbon derivativesorganic oxidesvinylogous acids |
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| Substituents | monocyclic benzene moietycarbonyl grouparyl alkyl ketonebenzoyl1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidphenylketoneketonebutyrophenonearomatic homomonocyclic compoundvinylogous acidorganic oxideorganic oxygen compoundlinear 1,7-diphenylheptane skeletonphenolhydrocarbon derivativebenzenoidalkyl-phenylketoneorganooxygen compoundaryl ketone |
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