| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:59 UTC |
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| Update Date | 2025-03-25 00:53:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201253 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H15O6+ |
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| Molecular Mass | 315.0863 |
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| SMILES | COc1ccc(-c2[o+]c3cc(OC)c(O)cc3cc2O)cc1O |
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| InChI Key | FFJMRSJNOSWBPH-UHFFFAOYSA-O |
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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 | o-methylated flavonoids |
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| Direct Parent | 4'-o-methylated flavonoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyrans1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids3'-hydroxyflavonoids3-hydroxyflavonoids6-hydroxyflavonoids7-o-methylated flavonoidsalkyl aryl ethersanisolesanthocyanidinsheteroaromatic compoundshydrocarbon derivativesmethoxybenzenesmethoxyphenolsorganic cationsoxacyclic compoundsphenoxy compounds |
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| Substituents | phenol ether3-hydroxyflavonoidmonocyclic benzene moietyether1-benzopyran1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etheraromatic heteropolycyclic compoundanthocyanidinorganic cationorganoheterocyclic compoundbenzopyran6-hydroxyflavonoidheteroaromatic compound1-hydroxy-4-unsubstituted benzenoidmethoxybenzene3'-hydroxyflavonoidoxacycleorganic oxygen compoundanisole4p-methoxyflavonoid-skeletonphenolhydrocarbon derivativebenzenoid7-methoxyflavonoid-skeletonphenoxy compoundorganooxygen compound |
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