Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 03:32:41 UTC |
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Update Date | 2025-03-21 22:49:48 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00562745 |
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Frequency | 2.9 |
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Structure | |
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Chemical Formula | C5H10O2 |
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Molecular Mass | 102.0681 |
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SMILES | OCC1(O)CCC1 |
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InChI Key | KTVGYAJQQQUOQX-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 | tertiary alcohols |
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Geometric Descriptor | aliphatic homomonocyclic compounds |
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Alternative Parents | 1,2-diolscyclic alcohols and derivativeshydrocarbon derivatives |
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Substituents | tertiary alcoholcyclobutanolaliphatic homomonocyclic compoundhydrocarbon derivative1,2-diol |
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