Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 04:38:04 UTC |
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Update Date | 2025-03-24 13:59:44 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00717949 |
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Frequency | 2.1 |
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Structure | |
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Chemical Formula | C5H6O3 |
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Molecular Mass | 114.0317 |
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SMILES | C=C1C(=O)OCC1O |
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InChI Key | BFLSLERVRLOFCX-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 | gamma butyrolactones |
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Direct Parent | gamma butyrolactones |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | carbonyl compoundsenoate estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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Substituents | enoate esteralcoholcarbonyl grouptetrahydrofurancarboxylic acid derivativegamma butyrolactoneoxacyclealpha,beta-unsaturated carboxylic esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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