Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:37:32 UTC |
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Update Date | 2025-03-25 00:45:35 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02150041 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C27H47NO21 |
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Molecular Mass | 721.2641 |
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SMILES | CC(=O)NC1C(O)C(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC1C(CO)OC(OC2C(CO)OC(O)C(O)C2O)C(O)C1O |
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InChI Key | OBRPFHSCDOIKKY-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 | alcohols and polyols |
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Direct Parent | cyclohexanols |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | acetalsacetamidescarbonyl compoundscarboxylic acids and derivativescyclitols and derivativesdialkyl ethershemiacetalshydrocarbon derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary carboxylic acid amides |
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Substituents | carbonyl groupethermonosaccharidecarboxylic acid derivativedialkyl ethersaccharideorganic oxideacetalaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhemiacetaloxaneprimary alcoholorganoheterocyclic compoundacetamidecyclohexanolcyclitol or derivativescyclic alcoholcarboxamide groupoxacyclesecondary carboxylic acid amidehydrocarbon derivativeorganic nitrogen compound |
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