Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:45:04 UTC |
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Update Date | 2025-03-25 00:48:17 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02167235 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C21H35NO17 |
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Molecular Mass | 573.1905 |
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SMILES | CC(=O)NC1C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C(O)C(O)C1C(=O)O |
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InChI Key | LNHFETXGDUCTST-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 | acetalsacetamidesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidscyclitols and derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary carboxylic acid amides |
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Substituents | carbonyl groupcarboxylic acidmonosaccharidecarboxylic acid derivativebeta-hydroxy acidsaccharideorganic oxideacetalaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholorganoheterocyclic compoundacetamidecyclohexanolcyclitol or derivativeshydroxy acidcyclic alcoholcarboxamide groupoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compound |
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