Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:54:19 UTC |
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Update Date | 2025-03-25 00:51:38 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02188367 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C13H22N4O8 |
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Molecular Mass | 362.1438 |
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SMILES | CC(O)C(NC(=O)C(N)CCC(=O)O)C(=O)NC(CC(N)=O)C(=O)O |
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InChI Key | JVYNYWXHZWVJEF-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic polymers |
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Class | polypeptides |
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Subclass | polypeptides |
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Direct Parent | polypeptides |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | alpha amino acid amidesalpha amino acidsasparagine and derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesglutamic acid and derivativeshydrocarbon derivativeshydroxy fatty acidsmonoalkylaminesn-acyl aminesn-acyl-alpha amino acidsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspeptidesprimary carboxylic acid amidessecondary alcoholssecondary carboxylic acid amidesshort-chain hydroxy acids and derivatives |
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Substituents | primary carboxylic acid amidefatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidfatty amidefatty acidalpha-amino acid or derivativescarboxylic acid derivativealpha peptideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydroxy fatty acidasparagine or derivativesn-acyl-alpha amino acid or derivativesalcoholpolypeptidealpha-amino acid amiden-acyl-alpha-amino acidglutamic acid or derivativescarboxamide groupn-acyl-aminen-substituted-alpha-amino acidsecondary carboxylic acid amideorganic oxygen compoundsecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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