Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:38:17 UTC |
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Update Date | 2025-03-25 00:45:52 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02151783 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C8H16N2O4 |
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Molecular Mass | 204.111 |
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SMILES | NC(CCC(=O)O)CC(=O)NCCO |
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InChI Key | FLDGCFAIAWYUJW-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 | beta amino acids and derivatives |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | alcohols and polyolsalkanolaminesamino fatty acidscarbonyl compoundscarboxylic acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonoalkylaminesmonocarboxylic acids and derivativesn-acyl aminesn-acylethanolaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidfatty amidefatty acidmedium-chain hydroxy acidorganic oxideorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidhydroxy fatty acidalkanolaminealcoholcarboxamide groupn-acylethanolamineamino fatty acidn-acyl-aminebeta amino acid or derivativessecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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