Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:39:09 UTC |
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Update Date | 2025-03-25 00:46:11 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02153848 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C8H16O3 |
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Molecular Mass | 160.1099 |
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SMILES | CC(=O)CCC(C)C(O)CO |
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InChI Key | IJAUDKXWQRDIKV-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 | 1,2-diolshydrocarbon derivativesketonesorganic oxidesprimary alcoholssecondary alcohols |
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Substituents | alcoholaliphatic acyclic compoundcarbonyl groupketoneorganic oxideorganic oxygen compoundfatty alcoholsecondary alcoholhydrocarbon derivativeprimary alcoholorganooxygen compound1,2-diol |
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