| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:40:42 UTC |
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| Update Date | 2025-03-21 17:58:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00016883 |
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| Frequency | 251.8 |
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| Structure | |
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| Chemical Formula | C8H16O2 |
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| Molecular Mass | 144.115 |
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| SMILES | CCC(O)CCCC(C)=O |
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| InChI Key | MNQCELSIBNJMDF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty alcohols |
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| Direct Parent | fatty alcohols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesketonesorganic oxidessecondary alcohols |
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| Substituents | ketonealcoholaliphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundfatty alcoholsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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