| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:00:33 UTC |
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| Update Date | 2025-03-21 18:06:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00063451 |
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| Frequency | 48.7 |
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| Structure | |
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| Chemical Formula | C19H22O6 |
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| Molecular Mass | 346.1416 |
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| SMILES | COc1cc(CCC(=O)CC(O)c2ccc(O)c(OC)c2)ccc1O |
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| InChI Key | YXLASAXVWTVWSO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenols |
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| Subclass | methoxyphenols |
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| Direct Parent | gingerols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesaromatic alcoholsbeta-hydroxy ketonesfatty alcoholshydrocarbon derivativesmethoxybenzenesorganic oxidesparadolsphenoxy compoundssecondary alcohols |
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| Substituents | aromatic alcoholfatty acylbeta-hydroxy ketonephenol ethermonocyclic benzene moietycarbonyl groupether1-hydroxy-2-unsubstituted benzenoidalkyl aryl etherketoneorganic oxidefatty alcoholalcoholmethoxybenzeneparadolaromatic homomonocyclic compoundgingerolorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativephenoxy compoundorganooxygen compound |
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