| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:36 UTC |
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| Update Date | 2025-03-25 00:48:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02166153 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C22H36N2O18 |
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| Molecular Mass | 616.1963 |
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| SMILES | CC(=O)NC1C(O)OC(CO)C(OC2OC(COC3OC(C(=O)NCC(=O)O)C(O)C(O)C3O)C(O)C(O)C2O)C1O |
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| InChI Key | UOHDDRMKSBHXIT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | acyl glycines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetalsacetamidesacylaminosugarsalpha amino acidscarbonyl compoundscarboxylic acidshemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesn-acyl-alpha-hexosaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholspyran carboxylic acidspyranssecondary alcoholssecondary carboxylic acid amides |
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| Substituents | carbonyl groupcarboxylic acidmonosacchariden-acyl-alpha-hexosaminesaccharideorganic oxideacetalaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhemiacetaloxaneprimary alcoholorganoheterocyclic compoundacetamidealcoholamino saccharidepyran carboxylic acid or derivativescarboxamide groupn-acylglycineacylaminosugaroxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundpyransecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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