| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:25 UTC |
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| Update Date | 2025-03-25 00:46:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154468 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C29H40O14 |
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| Molecular Mass | 612.2418 |
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| SMILES | COc1cc(CC(CO)C(CCC(=O)OCOC2OC(C(O)O)C(O)C(O)C2O)Cc2ccc(O)c(OC)c2)ccc1O |
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| InChI Key | HOQLOSSATRAVMP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lignans, neolignans and related compounds |
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| Class | lignan glycosides |
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| Subclass | lignan glycosides |
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| Direct Parent | lignan glycosides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsacetalsalkyl aryl ethersalkyl glycosidesanisolescarbonyl compoundscarbonyl hydratescarboxylic acid estersdibenzylbutane lignansfatty acid estersfatty acyl glycosides of mono- and disaccharidesfatty alcoholshydrocarbon derivativesmethoxybenzenesmethoxyphenolsmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesphenoxy compoundsprimary alcoholssecondary alcohols |
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| Substituents | fatty acylfatty acyl glycoside of mono- or disaccharidephenol ethermonocyclic benzene moietycarbonyl groupethercarbonyl hydratearomatic heteromonocyclic compoundlignan glycoside1-hydroxy-2-unsubstituted benzenoidmethoxyphenolmonosaccharidealkyl aryl ethercarboxylic acid derivativedibenzylbutane lignan skeletonsaccharideorganic oxideacetalfatty alcoholoxaneprimary alcoholorganoheterocyclic compoundalcoholfatty acyl glycosidemethoxybenzeneoxacyclefatty acid estermonocarboxylic acid or derivativesorganic oxygen compoundanisolecarboxylic acid estersecondary alcoholphenolhydrocarbon derivativebenzenoidphenoxy compoundorganooxygen compoundalkyl glycoside |
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