Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:43:35 UTC |
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Update Date | 2025-03-25 00:47:44 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02163756 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C10H16O2 |
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Molecular Mass | 168.115 |
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SMILES | CC1(C)CC2C1C(=O)OC2(C)C |
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InChI Key | ANFKDQOHJGBXDD-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 heteropolycyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxepanestetrahydrofurans |
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Substituents | carbonyl grouptetrahydrofurancarboxylic acid derivativegamma butyrolactonealiphatic heteropolycyclic compoundoxepaneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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