| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:48:15 UTC |
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| Update Date | 2025-03-21 18:01:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00034320 |
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| Frequency | 104.9 |
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| Structure | |
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| Chemical Formula | C5H7Cl3O3 |
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| Molecular Mass | 219.9461 |
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| SMILES | OC1C(CCl)OC(Cl)(Cl)C1O |
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| InChI Key | MKOBTBRPKGMDQH-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 | carbohydrates and carbohydrate conjugates |
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| Direct Parent | monosaccharides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsalkyl chlorideschlorohydrinsdialkyl ethershydrocarbon derivativesorganochloridesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholetherchlorohydrintetrahydrofuranhalohydrinalkyl chlorideorganochloridemonosaccharideorganohalogen compounddialkyl etheroxacyclealiphatic heteromonocyclic compoundsecondary alcoholalkyl halidehydrocarbon derivativeorganoheterocyclic compound1,2-diol |
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