Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 13:38:32 UTC |
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Update Date | 2025-03-24 22:09:37 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02011114 |
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Frequency | 0.6 |
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Structure | |
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Chemical Formula | C6H10O2 |
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Molecular Mass | 114.0681 |
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SMILES | CC12CC(O)CC1O2 |
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InChI Key | QGRDPTGSYJMMIE-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 heteropolycyclic compounds |
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Alternative Parents | cyclic alcohols and derivativesdialkyl ethersepoxideshydrocarbon derivativesoxacyclic compoundssecondary alcohols |
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Substituents | alcoholetheroxiranecyclic alcoholdialkyl etheraliphatic heteropolycyclic compoundoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativeoxaneorganooxygen compound |
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