| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:03 UTC |
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| Update Date | 2025-03-21 18:35:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00105537 |
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| Frequency | 25.6 |
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| Structure | |
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| Chemical Formula | C12H20N4O8 |
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| Molecular Mass | 348.1281 |
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| SMILES | N=C(NCCCC(NCC(=O)O)C(=O)O)NC(CC(=O)O)C(=O)O |
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| InChI Key | KMCAIQGXGUSYNQ-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 | arginine and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsaspartic acid and derivativescarbonyl compoundscarboximidamidescarboxylic acidsdialkylaminesguanidineshydrocarbon derivativesiminesorganic oxidesorganopnictogen compoundstetracarboxylic acids and derivatives |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidguanidineimineorganic oxidearginine or derivativesorganonitrogen compoundalpha-amino acidorganopnictogen compoundsecondary aliphatic aminetetracarboxylic acid or derivativescarboximidamidesecondary amineorganic oxygen compoundaspartic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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