| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:13 UTC |
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| Update Date | 2025-03-25 00:46:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158484 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H12O5 |
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| Molecular Mass | 176.0685 |
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| SMILES | OCC1OC(O)C(O)C=CC1O |
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| InChI Key | JIHQOKWMJSFXIM-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | ethers |
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| Direct Parent | hemiacetals |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativesoxacyclic compoundsprimary alcoholssecondary alcohols |
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| Substituents | alcoholoxacyclealiphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeprimary alcoholorganoheterocyclic compound |
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