Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:15:12 UTC |
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Update Date | 2025-03-21 18:33:58 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00098562 |
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Frequency | 27.9 |
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Structure | |
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Chemical Formula | C12H18O13 |
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Molecular Mass | 370.0747 |
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SMILES | O=CC(O)C(OC1OC(C(=O)O)C(O)C(O)C1O)C(O)C(O)C(=O)O |
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InChI Key | WXYDMIBFFSRSPZ-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 | aliphatic heteromonocyclic compounds |
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Alternative Parents | acetalsalpha hydroxy acids and derivativesalpha-hydroxyaldehydesbeta hydroxy acids and derivativescarboxylic acidsdicarboxylic acids and derivativesglucuronic acid derivativesheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonosaccharideso-glucuronidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcohols |
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Substituents | fatty acylcarbonyl groupcarboxylic acidglucuronic acid or derivativesheterocyclic fatty acidalpha-hydroxy acido-glucuronidemonosaccharidefatty acidcarboxylic acid derivativepyran carboxylic acidmedium-chain hydroxy acid1-o-glucuronidebeta-hydroxy acidsaccharideorganic oxidealpha-hydroxyaldehydeacetalaliphatic heteromonocyclic compoundmedium-chain fatty acidhydroxy fatty acidoxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativesaldehydehydroxy acidoxacycleorganic oxygen compoundpyransecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativesaccharolipidorganooxygen compound |
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