| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:44 UTC |
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| Update Date | 2025-03-21 18:39:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00124023 |
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| Frequency | 20.8 |
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| Structure | |
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| Chemical Formula | C9H8N4O3 |
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| Molecular Mass | 220.0596 |
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| SMILES | O=C1NC(=O)C(NC(=O)c2cccnc2)N1 |
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| InChI Key | YXQCFIZMHVNYNI-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 | n-acyl-alpha amino acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdicarboximidesheteroaromatic compoundshydantoinshydrocarbon derivativesimidazolidinonesnicotinamidesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyridinecarboxylic acids and derivativessecondary carboxylic acid amides |
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| Substituents | imidazolidinepyridine carboxylic acid or derivativescarbonyl grouparomatic heteromonocyclic compoundnicotinamideimidazolidinoneorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compounddicarboximideorganoheterocyclic compoundcarbonic acid derivativeazacyclen-acyl-alpha-amino acidheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amidepyridineorganic oxygen compoundhydantoinhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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