| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:45 UTC |
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| Update Date | 2025-03-25 00:59:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02239502 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H18N4O9 |
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| Molecular Mass | 362.1074 |
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| SMILES | N=C(NCCC(=O)NC(CC(=O)O)C(=O)O)NC(CC(=O)O)C(=O)O |
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| InChI Key | ABCRADPWGNGTBP-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 | peptidomimetics |
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| Subclass | hybrid peptides |
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| Direct Parent | hybrid peptides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidsaspartic acid and derivativesbeta amino acids and derivativescarbonyl compoundscarboximidamidescarboxylic acidsguanidineshydrocarbon derivativesiminesn-acyl-alpha amino acidsorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidestetracarboxylic acids and derivatives |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidguanidineiminealpha-amino acid or derivativescarboxylic acid derivativeorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundn-acyl-alpha amino acid or derivativesn-acyl-alpha-amino acidtetracarboxylic acid or derivativescarboximidamidecarboxamide groupbeta amino acid or derivativessecondary carboxylic acid amideorganic oxygen compoundaspartic acid or derivativeshybrid peptidehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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