| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:43 UTC |
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| Update Date | 2025-03-25 01:00:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02241749 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14O6 |
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| Molecular Mass | 206.079 |
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| SMILES | CC1(C(O)CO)CCC(O)(C(=O)O)O1 |
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| InChI Key | TWCXRIYMHYYGQQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | hydroxy acids and derivatives |
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| Subclass | alpha hydroxy acids and derivatives |
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| Direct Parent | alpha hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolscarbonyl compoundscarboxylic acidshemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholcarbonyl groupcarboxylic acidtetrahydrofuranalpha-hydroxy acidcarboxylic acid derivativeoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeprimary alcoholorganoheterocyclic compoundorganooxygen compound1,2-diol |
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