Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 13:24:03 UTC |
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Update Date | 2025-03-24 22:03:18 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01976363 |
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Frequency | 0.6 |
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Structure | |
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Chemical Formula | C6H12O2 |
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Molecular Mass | 116.0837 |
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SMILES | C=CC(CO)OCC |
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InChI Key | QDHSRSQZYZLBKM-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 | ethers |
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Direct Parent | dialkyl ethers |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | hydrocarbon derivativesprimary alcohols |
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Substituents | alcoholaliphatic acyclic compoundhydrocarbon derivativeprimary alcoholdialkyl ether |
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