Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:37:14 UTC |
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Update Date | 2025-03-25 00:45:28 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02149324 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C16H28O6 |
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Molecular Mass | 316.1886 |
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SMILES | CC(C)C(=O)OCOC(=O)C(C)C(OC(=O)C(C)C)C(C)C |
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InChI Key | LRMUYYKXBZGWMS-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 | tricarboxylic acids and derivatives |
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Direct Parent | tricarboxylic acids and derivatives |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | acetalsacylalscarbonyl compoundsfatty acid estershydrocarbon derivativesorganic oxides |
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Substituents | fatty acylaliphatic acyclic compoundcarbonyl grouptricarboxylic acid or derivativesacylalfatty acid esterorganic oxideorganic oxygen compoundacetalcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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