| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:03:24 UTC |
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| Update Date | 2025-03-25 00:54:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02209075 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H16O5 |
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| Molecular Mass | 204.0998 |
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| SMILES | CC(C)C(=O)OCOC(=O)C(C)(C)O |
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| InChI Key | VDAUCZIVKAHVFL-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 | acylals |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetalscarbonyl compoundsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidestertiary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupacylaltertiary alcoholorganic oxideorganic oxygen compoundacetaldicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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