| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:25 UTC |
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| Update Date | 2025-03-25 00:53:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02202217 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H15NO6 |
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| Molecular Mass | 209.0899 |
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| SMILES | C[N+](C)([O-])CC(O)C(O)C(O)C(=O)O |
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| InChI Key | YJLVTUQPLGMHKQ-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 | hydroxy acids and derivatives |
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| Subclass | beta hydroxy acids and derivatives |
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| Direct Parent | beta hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativeshydroxy fatty acidsmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganic oxoanionic compoundsorganopnictogen compoundssecondary alcoholsshort-chain hydroxy acids and derivativestrialkyl amine oxidestrisubstituted amine oxides and derivatives |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidalpha-hydroxy acidtrialkyl amine oxidemonosaccharidefatty acidcarboxylic acid derivativebeta-hydroxy acidsaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundhydroxy fatty acidalcoholn-oxidemonocarboxylic acid or derivativesorganic oxygen compoundtrisubstituted n-oxideaminoxidesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundorganic hyponitrite |
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