| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:53:57 UTC |
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| Update Date | 2025-03-21 22:01:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00470912 |
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| Frequency | 3.7 |
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| Structure | |
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| Chemical Formula | C7H12O2 |
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| Molecular Mass | 128.0837 |
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| SMILES | C=CC1(O)CCOCC1 |
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| InChI Key | SBQQUBMTHFCTBP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | oxanes |
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| Subclass | oxanes |
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| Direct Parent | oxanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | dialkyl ethershydrocarbon derivativesoxacyclic compoundstertiary alcohols |
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| Substituents | alcoholoxacycletertiary alcoholetherorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativeoxanedialkyl etherorganooxygen compound |
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