| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:52 UTC |
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| Update Date | 2025-03-25 00:50:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182767 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H26O13 |
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| Molecular Mass | 462.1373 |
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| SMILES | O=CC(O)C(OC1OC(CO)C(O)C(O)C1O)C(Cc1ccc(O)c(O)c1)C(O)C(=O)O |
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| InChI Key | JNGYUUORFLQFIC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | saccharolipids |
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| Subclass | saccharolipids |
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| Direct Parent | saccharolipids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsacetalsalpha hydroxy acids and derivativesalpha-hydroxyaldehydesbenzene and substituted derivativesbranched fatty acidscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesprimary alcoholssecondary alcohols |
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| Substituents | fatty acylmonocyclic benzene moietycarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundheterocyclic fatty acidalpha-hydroxy acid1-hydroxy-2-unsubstituted benzenoidmonosaccharidefatty acidcarboxylic acid derivativemedium-chain hydroxy acidsaccharideorganic oxidealpha-hydroxyaldehydeacetalmedium-chain fatty acidhydroxy fatty acidoxaneprimary alcoholorganoheterocyclic compoundalcoholaldehydehydroxy acid1-hydroxy-4-unsubstituted benzenoidbranched fatty acidoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholphenolhydrocarbon derivativebenzenoidsaccharolipidorganooxygen compound |
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