| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:10:38 UTC |
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| Update Date | 2025-03-21 18:31:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00087543 |
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| Frequency | 32.5 |
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| Structure | |
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| Chemical Formula | C8H17NO4 |
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| Molecular Mass | 191.1158 |
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| SMILES | CC(=O)OCCN(CCO)CCO |
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| InChI Key | COYBSBIBDYUILE-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 | carboxylic acid derivatives |
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| Direct Parent | carboxylic acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsalcohols and polyolsamino acids and derivativescarbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundstrialkylamines |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl group1,2-aminoalcoholamino acid or derivativestertiary aliphatic amineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundaminetertiary amineorganooxygen compoundalkanolamine |
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