| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:45:08 UTC |
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| Update Date | 2025-03-25 00:48:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02167372 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C25H42N2O18 |
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| Molecular Mass | 658.2433 |
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| SMILES | CC(=O)NC1CC(OCC2C(O)C(O)C(O)C(OC3C(CO)OC(NC(C)=O)C(O)C3O)C2O)(C(=O)O)OC1C(O)C(O)CO |
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| InChI Key | QORIVCBENOPXKE-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 | gamma amino acids and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetamidescarbonyl compoundscarboxylic acidscyclitols and derivativescyclohexanolsdialkyl ethershydrocarbon derivativesketalsmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary carboxylic acid amidestetrahydrofurans |
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| Substituents | carbonyl groupethercarboxylic acidgamma amino acid or derivativesmonosaccharidedialkyl ethersaccharideorganic oxideacetalketalaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholorganoheterocyclic compoundacetamidealcoholtetrahydrofurancyclohexanolcyclitol or derivativescyclic alcoholcarboxamide groupoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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