| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:28 UTC |
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| Update Date | 2025-03-25 00:57:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02225453 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H16O5 |
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| Molecular Mass | 300.0998 |
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| SMILES | CC(=O)c1cc(O)cc2c1CC(O)C(c1ccc(O)cc1)O2 |
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| InChI Key | RXWFPQITKLCGNO-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 | flavonoids |
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| Subclass | hydroxyflavonoids |
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| Direct Parent | 3-hydroxyflavonoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyrans1-hydroxy-2-unsubstituted benzenoids4'-hydroxyflavonoids7-hydroxyflavonoidsacetophenonesalkyl aryl ethersaryl alkyl ketonesflavan-3-olshydrocarbon derivativesorganic oxidesoxacyclic compoundssecondary alcohols |
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| Substituents | monocyclic benzene moiety3-hydroxyflavonoidetheraryl alkyl ketone1-benzopyranflavan1-hydroxy-2-unsubstituted benzenoidalkyl aryl etherketoneorganic oxidearomatic heteropolycyclic compoundacetophenonechromaneflavan-3-olorganoheterocyclic compoundalcoholbenzopyranoxacycleorganic oxygen compound7-hydroxyflavonoidsecondary alcohol4'-hydroxyflavonoidphenolhydrocarbon derivativebenzenoidorganooxygen compoundaryl ketone |
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