Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:54:00 UTC |
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Update Date | 2025-03-25 00:51:32 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02187643 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C16H30O2 |
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Molecular Mass | 254.2246 |
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SMILES | CC(C)C(=O)OC(C(C)C)C1CCCCC1(C)C |
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InChI Key | VPVRCSGSHOWARR-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic acids and derivatives |
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Class | carboxylic acids and derivatives |
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Subclass | carboxylic acid derivatives |
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Direct Parent | carboxylic acid esters |
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Geometric Descriptor | aliphatic homomonocyclic compounds |
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Alternative Parents | carbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | carbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic homomonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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