Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 10:36:00 UTC |
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Update Date | 2025-03-24 20:49:22 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01577150 |
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Frequency | 0.8 |
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Structure | |
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Chemical Formula | C49H87N3O42P2 |
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Molecular Mass | 1451.4239 |
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SMILES | CC(=O)NC1C(OC2C(O)C(CO)OC(OC3C(O)C(OC4OC(CO)C(NC(C)=O)C(OC5OC(CO)C(O)C(O)C5O)C4O)C(OP(=O)(O)OP(=O)(O)OCCN)C3C(O)CO)C2O)OC(CO)C(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C1O |
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InChI Key | UXRAKOCDSNERAT-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 | n-acyl-alpha-hexosamines |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | acetalsacetamidescarbonyl compoundscarboxylic acids and derivativescyclitols and derivativescyclopentanolshydrocarbon derivativesmonoalkyl phosphatesmonoalkylaminesmonosaccharidesorganic oxidesorganic pyrophosphatesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesphosphoethanolaminesprimary alcoholssecondary carboxylic acid amides |
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Substituents | carbonyl groupmonosaccharidecarboxylic acid derivativen-acyl-alpha-hexosaminephosphoethanolamineorganic oxideacetalaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholorganoheterocyclic compoundacetamidealcoholcyclitol or derivativescyclic alcoholcarboxamide grouporganic pyrophosphatecyclopentanoloxacyclesecondary carboxylic acid amidephosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphate |
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