| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:10:21 UTC |
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| Update Date | 2025-03-21 18:31:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00086931 |
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| Frequency | 32.8 |
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| Structure | |
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| Chemical Formula | C9H12O8 |
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| Molecular Mass | 248.0532 |
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| SMILES | CC(OC1=C(O)C(=O)OC1C(O)CO)C(=O)O |
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| InChI Key | ZNBFWESWYHJDNB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | dihydrofurans |
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| Subclass | furanones |
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| Direct Parent | butenolides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesdihydrofuransenoate estershydrocarbon derivativeslactonesmonosaccharidesorganic oxidesoxacyclic compoundsprimary alcoholssecondary alcoholsvinylogous esters |
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| Substituents | carbonyl groupcarboxylic acidmonosaccharidecarboxylic acid derivativelactonealpha,beta-unsaturated carboxylic ester2-furanonesaccharideorganic oxidealiphatic heteromonocyclic compoundprimary alcohol1,2-diolenoate esteralcoholvinylogous esteroxacycleorganic oxygen compoundcarboxylic acid estersecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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