Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:48:11 UTC |
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Update Date | 2025-03-21 18:01:40 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00034180 |
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Frequency | 105.4 |
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Structure | |
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Chemical Formula | C18H16O5 |
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Molecular Mass | 312.0998 |
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SMILES | COc1ccc(-c2coc3cc(OC)c(OC)cc3c2=O)cc1 |
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InChI Key | YHXIOAVHEXKZCQ-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 | o-methylated isoflavonoids |
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Direct Parent | 7-o-methylisoflavones |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | alkyl aryl ethersanisoleschromonesheteroaromatic compoundshydrocarbon derivativesisoflavonesisoflavonoidsmethoxybenzenesorganic oxidesoxacyclic compoundsphenoxy compoundspyranones and derivatives |
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Substituents | phenol ethermonocyclic benzene moietyether1-benzopyranalkyl aryl etherorganic oxidechromonearomatic heteropolycyclic compoundpyranoneorganoheterocyclic compound7-o-methylisoflavoneisoflavonebenzopyranheteroaromatic compoundmethoxybenzeneoxacycleorganic oxygen compoundpyrananisolehydrocarbon derivativebenzenoidphenoxy compoundorganooxygen compound |
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