| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:20:34 UTC |
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| Update Date | 2025-03-25 00:15:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01253590 |
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| Frequency | 1.1 |
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| Structure | |
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| Chemical Formula | C9H12O |
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| Molecular Mass | 136.0888 |
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| SMILES | CC12C=CC(CC1)C1OC12 |
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| InChI Key | PGBXBOIZERZZBP-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 | oxepanes |
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| Subclass | oxepanes |
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| Direct Parent | oxepanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | dialkyl ethersepoxideshydrocarbon derivativesoxacyclic compounds |
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| Substituents | aliphatic heteropolycyclic compoundoxepaneoxacycleetherorganic oxygen compoundoxiranehydrocarbon derivativedialkyl etherorganooxygen compound |
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