Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:38:41 UTC |
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Update Date | 2025-03-25 00:46:01 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02152716 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C11H14N4O6 |
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Molecular Mass | 298.0913 |
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SMILES | N=C(N)Nc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)o1 |
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InChI Key | YXOUGLHPILSQIO-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 | glutamic acid and derivatives |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 2-heteroaryl carboxamidesalpha amino acidscarbonyl compoundscarboximidamidescarboxylic acidsdicarboxylic acids and derivativesfuroic acid and derivativesguanidinesheteroaromatic compoundshydrocarbon derivativesiminesn-acyl-alpha amino acidsorganic oxidesorganopnictogen compoundsoxacyclic compoundssecondary carboxylic acid amides |
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Substituents | furancarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundguanidineimine2-heteroaryl carboxamideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesfuroic acid or derivativesn-acyl-alpha-amino acidheteroaromatic compoundglutamic acid or derivativescarboximidamidecarboxamide groupoxacyclesecondary carboxylic acid amideorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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