| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:30 UTC |
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| Update Date | 2025-03-25 00:56:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02218687 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H14O3 |
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| Molecular Mass | 254.0943 |
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| SMILES | Cc1ccc2c(c1)OC(=O)CC2c1ccc(O)cc1 |
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| InChI Key | GVGASOKJMXICNV-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 | neoflavonoids |
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| Subclass | neoflavans |
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| Direct Parent | neoflavans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyrans1-hydroxy-2-unsubstituted benzenoids3,4-dihydrocoumarinsbenzene and substituted derivativescarbonyl compoundscarboxylic acid estershydrocarbon derivativeslactonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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| Substituents | neoflavanmonocyclic benzene moietycarbonyl groupbenzopyran1-benzopyran3,4-dihydrocoumarin1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativelactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundcarboxylic acid esterchromanephenolhydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compound |
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