| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:56:18 UTC |
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| Update Date | 2025-03-21 18:04:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00053458 |
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| Frequency | 60.5 |
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| Structure | |
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| Chemical Formula | C6H8O6 |
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| Molecular Mass | 176.0321 |
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| SMILES | O=C1CC(O)(C(=O)O)CC(O)O1 |
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| InChI Key | HFXTUAVKVCUCAY-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 | lactones |
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| Subclass | delta valerolactones |
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| Direct Parent | delta valerolactones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativescarbonyl compoundscarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativeshemiacetalshydrocarbon derivativesorganic oxidesoxacyclic compoundsoxanestertiary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic aciddelta valerolactonealpha-hydroxy acidhydroxy acidcarboxylic acid derivativeoxacycletertiary alcoholorganic oxideorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compounddicarboxylic acid or derivativeshemiacetalhydrocarbon derivativeoxanedelta_valerolactoneorganooxygen compound |
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