| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:27:02 UTC |
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| Update Date | 2025-03-24 20:19:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01411877 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C8H12O2 |
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| Molecular Mass | 140.0837 |
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| SMILES | CC1(O)CC2C=CC(C1)O2 |
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| InChI Key | BRJQVMNTAPIFBP-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 | dialkyl ethersdihydrofuranshydrocarbon derivativesoxacyclic compoundstertiary alcohols |
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| Substituents | alcoholetherdialkyl etheraliphatic heteropolycyclic compoundoxacycletertiary alcoholorganic oxygen compoundhydrocarbon derivativeoxaneorganooxygen compounddihydrofuran |
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