Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 04:09:31 UTC |
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Update Date | 2025-03-21 23:09:16 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00649863 |
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Frequency | 2.4 |
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Structure | |
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Chemical Formula | C4H6O4 |
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Molecular Mass | 118.0266 |
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SMILES | O=C1OCC1(O)CO |
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InChI Key | IAGIJHUSIBOZJH-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 | beta propiolactones |
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Direct Parent | beta propiolactones |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | 1,2-diolscarbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxetanestertiary alcohols |
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Substituents | alcoholcarbonyl groupcarboxylic acid derivativebeta_propiolactoneoxacycletertiary alcoholorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteroxetanealiphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound1,2-diol |
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