| Record Information |
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| HMDB Status | predicted |
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| Creation Date | 2024-02-20 23:50:29 UTC |
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| Update Date | 2025-03-21 18:02:41 UTC |
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| HMDB ID | HMDB0130132 |
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| Metabolite Identification |
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| DeepMet ID | DMID00039653 |
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| Name | 6-(3-carboxypropoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid |
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| Frequency | 87.6 |
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| Structure | |
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| Chemical Formula | C10H16O9 |
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| Molecular Mass | 280.0794 |
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| SMILES | O=C(O)CCCOC1OC(C(=O)O)C(O)C(O)C1O |
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| InChI Key | XHBNGIHZUGLAMW-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 | acetalsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesglucuronic acid derivativesheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidsmonosaccharideso-glucuronidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcoholsshort-chain hydroxy acids and derivatives |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidshort-chain hydroxy acidglucuronic acid or derivativesheterocyclic fatty acido-glucuronidemonosaccharidefatty acidcarboxylic acid derivativepyran carboxylic acid1-o-glucuronidebeta-hydroxy acidsaccharideorganic oxideacetalaliphatic heteromonocyclic compoundhydroxy fatty acidoxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativeshydroxy acidoxacycleorganic oxygen compoundpyransecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativesaccharolipidorganooxygen compound |
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