| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:18 UTC |
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| Update Date | 2025-03-25 01:01:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02250079 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H18NO5+ |
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| Molecular Mass | 220.1179 |
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| SMILES | C[N+](C)(C)C1C(=O)OC(CO)C(O)C1O |
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| InChI Key | FISRWYGEVYYUDM-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 | alpha amino acid esters |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsaminesaminosaccharidescarbonyl compoundscarboxylic acid estersdelta valerolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcoholstetraalkylammonium salts |
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| Substituents | carbonyl groupdelta valerolactonemonosaccharidelactonesaccharideorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic cationoxaneorganic saltprimary alcoholdelta_valerolactoneorganoheterocyclic compoundalcoholamino saccharidetetraalkylammonium saltalpha-amino acid esterquaternary ammonium saltoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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