| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:24 UTC |
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| Update Date | 2025-03-25 00:58:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02231922 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20O4 |
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| Molecular Mass | 228.1362 |
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| SMILES | CC1(CCC2CCC(=O)O2)CCC(O)CO1 |
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| InChI Key | YVUPASALYNUYJO-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 | oxanes |
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| Subclass | oxanes |
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| Direct Parent | oxanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estersdialkyl ethersgamma butyrolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholcarbonyl groupethertetrahydrofurancarboxylic acid derivativedialkyl ethergamma butyrolactonelactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeoxaneorganooxygen compound |
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