| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:53:49 UTC |
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| Update Date | 2025-03-25 00:29:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02047386 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C8H10O2 |
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| Molecular Mass | 138.0681 |
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| SMILES | OC1CC2C=CC1C1OC21 |
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| InChI Key | QMFZWPOINMLUMT-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 | cyclic alcohols and derivativesdialkyl ethersepoxideshydrocarbon derivativesoxacyclic compoundssecondary alcohols |
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| Substituents | alcoholetheroxiranecyclic alcoholdialkyl etheraliphatic heteropolycyclic compoundoxepaneoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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