| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:24 UTC |
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| Update Date | 2025-03-25 00:58:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02234208 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H10O4 |
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| Molecular Mass | 146.0579 |
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| SMILES | COC(=O)OCCC(C)=O |
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| InChI Key | RFLPLQOOSDYPQD-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 | organic carbonic acids and derivatives |
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| Subclass | carbonic acid diesters |
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| Direct Parent | carbonic acid diesters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesketonesorganic oxides |
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| Substituents | ketonealiphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundcarbonic acid diesterhydrocarbon derivativeorganooxygen compound |
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