| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-21 00:04:19 UTC |
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| Update Date | 2025-03-21 18:28:32 UTC |
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| HMDB ID | HMDB0041605 |
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| Metabolite Identification |
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| DeepMet ID | DMID00072474 |
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| Name | Propyleneglycol diacetate |
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| Frequency | 41.2 |
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| Structure | |
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| Chemical Formula | C7H12O4 |
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| Molecular Mass | 160.0736 |
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| SMILES | CC(=O)OCC(C)OC(C)=O |
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| InChI Key | MLHOXUWWKVQEJB-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 | dicarboxylic acids and derivatives |
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| Direct Parent | dicarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estershydrocarbon derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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