| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:48 UTC |
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| Update Date | 2025-03-25 00:50:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182628 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H19ClO9 |
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| Molecular Mass | 330.0718 |
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| SMILES | O=CC(O)C(O)C(OC1OC(CCl)C(O)C1O)C(O)CO |
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| InChI Key | LLMCQJORBMFEPH-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 | acetalsalkyl chloridesalpha-hydroxyaldehydesbeta-hydroxy aldehydeshydrocarbon derivativesorganic oxidesorganochloridesoxacyclic compoundsprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholbeta-hydroxy aldehydecarbonyl grouptetrahydrofuranalkyl chlorideorganochloridemonosaccharidealdehydeorganohalogen compoundoxacycleorganic oxidealpha-hydroxyaldehydeacetalaliphatic heteromonocyclic compoundsecondary alcoholalkyl halidehydrocarbon derivativeprimary alcoholorganoheterocyclic compound |
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