Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 01:47:58 UTC |
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Update Date | 2025-03-21 20:03:47 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00314693 |
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Frequency | 6.2 |
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Structure | |
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Chemical Formula | C6H8O3 |
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Molecular Mass | 128.0473 |
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SMILES | CC1=CC(=O)OC1CO |
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InChI Key | OUPXLQOHVPEXME-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 | carbonyl compoundsdihydrofuransenoate estershydrocarbon derivativeslactonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsprimary alcohols |
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Substituents | enoate esteralcoholcarbonyl groupcarboxylic acid derivativelactoneoxacyclealpha,beta-unsaturated carboxylic ester2-furanoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundhydrocarbon derivativeprimary alcoholorganooxygen compound |
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