Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:48:20 UTC |
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Update Date | 2025-03-25 00:49:29 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02174640 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C10H16O4 |
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Molecular Mass | 200.1049 |
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SMILES | CCCCC(O)C(=O)C1CCC(=O)O1 |
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InChI Key | BRURLCBXLBVZRT-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | carbonyl compounds |
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Direct Parent | alpha-acyloxy ketones |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | acyloinscarboxylic acid estersgamma butyrolactoneshydrocarbon derivativesketonesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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Substituents | alcoholalpha-acyloxy ketonetetrahydrofuranmonosaccharidecarboxylic acid derivativegamma butyrolactoneketonelactoneoxacyclesaccharideorganic oxidemonocarboxylic acid or derivativesacyloincarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeorganoheterocyclic compound |
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