| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:41 UTC |
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| Update Date | 2025-03-21 18:39:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00123905 |
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| Frequency | 20.8 |
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| Structure | |
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| Chemical Formula | C5H12O3 |
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| Molecular Mass | 120.0786 |
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| SMILES | COC(CO)C(C)O |
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| InChI Key | FTXUAWAGJFCCIT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | alcohols and polyols |
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| Direct Parent | secondary alcohols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | dialkyl ethershydrocarbon derivativesprimary alcohols |
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| Substituents | aliphatic acyclic compoundethersecondary alcoholhydrocarbon derivativeprimary alcoholdialkyl ether |
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