| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:32 UTC |
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| Update Date | 2025-03-25 01:00:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02241339 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H24ClNO10 |
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| Molecular Mass | 401.1089 |
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| SMILES | CC(=O)NC1OC(CO)C(OC2(CCl)OC(CO)C(O)C2O)C(O)C1O |
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| InChI Key | LOYBKWJZJGTXNR-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 | ketals |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetamidesalkyl chloridescarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesmonosaccharidesorganic oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcoholssecondary carboxylic acid amidestetrahydrofurans |
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| Substituents | carbonyl groupalkyl chlorideorganochloridemonosaccharidecarboxylic acid derivativeorganohalogen compoundsaccharideorganic oxideketalaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundalkyl halideoxaneprimary alcoholorganoheterocyclic compoundacetamidealcoholtetrahydrofurancarboxamide groupoxacyclesecondary carboxylic acid amidesecondary alcoholhydrocarbon derivativeorganic nitrogen compound |
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