| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:27 UTC |
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| Update Date | 2025-03-25 00:59:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02236607 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H18O8 |
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| Molecular Mass | 374.1002 |
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| SMILES | COc1ccc2c(c1)c(=O)oc1cc(OC3OCC(O)C(O)C3O)ccc12 |
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| InChI Key | OULPNOCEWCYKQL-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 | coumarins and derivatives |
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| Subclass | coumarins and derivatives |
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| Direct Parent | coumarins and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyrans2-benzopyransacetalsalkyl aryl ethersanisolesheteroaromatic compoundshydrocarbon derivativesisocoumarins and derivativeslactonesmonosaccharidesorganic oxidesoxacyclic compoundsoxanespyranones and derivativessecondary alcohols |
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| Substituents | phenol etherether1-benzopyranmonosaccharidealkyl aryl etherlactonesaccharideorganic oxideacetalaromatic heteropolycyclic compoundpyranoneoxaneorganoheterocyclic compoundalcoholbenzopyranheteroaromatic compoundisocoumarincoumarinoxacycleorganic oxygen compoundpyrananisole2-benzopyransecondary alcoholhydrocarbon derivativebenzenoidorganooxygen compound |
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