| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:53 UTC |
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| Update Date | 2025-03-25 00:45:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02150853 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H12O6 |
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| Molecular Mass | 312.0634 |
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| SMILES | CC(=O)Oc1ccc2occ(-c3ccc(O)c(O)c3)c(=O)c2c1 |
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| InChI Key | ZJXODPRFOXXOCC-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 | isoflavonoids |
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| Subclass | isoflav-2-enes |
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| Direct Parent | isoflavones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativescarbonyl compoundscarboxylic acid esterschromonesheteroaromatic compoundshydrocarbon derivativesisoflavonoidsmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundspyranones and derivatives |
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| Substituents | monocyclic benzene moietycarbonyl group1-benzopyran1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativeorganic oxidechromonearomatic heteropolycyclic compoundpyranoneorganoheterocyclic compoundisoflavonebenzopyranheteroaromatic compound1-hydroxy-4-unsubstituted benzenoidoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundpyrancarboxylic acid esterphenolhydrocarbon derivativebenzenoidorganooxygen compound |
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