| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:11:32 UTC |
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| Update Date | 2025-03-21 18:32:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00089629 |
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| Frequency | 31.5 |
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| Structure | |
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| Chemical Formula | C6H12N2O4 |
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| Molecular Mass | 176.0797 |
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| SMILES | NC(CCCCON=O)C(=O)O |
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| InChI Key | DZVKRLHACJGLCX-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 acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl nitritesamino fatty acidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonoalkylaminesmonocarboxylic acids and derivativesnitrite estersorganic o-nitroso compoundsorganic oxidesorganopnictogen compounds |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidfatty acidmedium-chain hydroxy acidalkyl nitriteorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundmedium-chain fatty acidnitrite esterorganic nitroso compoundamino fatty acidorganic nitritemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundorganic o-nitroso compound |
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