| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:26 UTC |
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| Update Date | 2025-03-21 18:05:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00058467 |
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| Frequency | 54.0 |
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| Structure | |
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| Chemical Formula | C7H11NO6 |
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| Molecular Mass | 205.0586 |
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| SMILES | NC(=O)CCC(O)(CC(=O)O)C(=O)O |
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| InChI Key | QJYPJBQFLXNNBV-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 | medium-chain hydroxy acids and derivatives |
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| Direct Parent | medium-chain hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativesamino fatty acidsbranched fatty acidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesfatty amideshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidestertiary alcohols |
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| Substituents | primary carboxylic acid amidefatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidalpha-hydroxy acidfatty amidefatty acidcarboxylic acid derivativemedium-chain hydroxy acidorganic oxideorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidhydroxy fatty acidalcoholcarboxamide groupamino fatty acidbranched fatty acidtertiary alcoholorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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