Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:22:10 UTC |
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Update Date | 2025-03-21 18:37:25 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00115618 |
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Frequency | 22.8 |
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Structure | |
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Chemical Formula | C9H14O3 |
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Molecular Mass | 170.0943 |
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SMILES | CCOC(=O)C1CCCC(=O)C1 |
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InChI Key | YLRVJPQVDQQBOX-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 | cyclic ketoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | ketonecarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic homomonocyclic compoundhydrocarbon derivativecyclic ketoneorganooxygen compound |
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