| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:26:09 UTC |
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| Update Date | 2025-03-21 18:39:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00124986 |
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| Frequency | 20.6 |
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| Structure | |
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| Chemical Formula | C11H13N5O3 |
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| Molecular Mass | 263.1018 |
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| SMILES | O=C1NCCN2C(=O)C(Cc3cnc[nH]3)NC(=O)C12 |
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| InChI Key | UDGOAGSEDMMFRX-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 | cyclic peptides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compounds2,5-dioxopiperazinesalpha amino acidsazacyclic compoundscarboxylic acids and derivativesdipeptidesheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsn-alkylpiperazinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidestertiary carboxylic acid amides |
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| Substituents | carbonyl grouplactamalpha-amino acid or derivatives2,5-dioxopiperazineorganic oxidedioxopiperazinepiperazinearomatic heteropolycyclic compoundimidazoletertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundazoleazacyclen-alkylpiperazineheteroaromatic compoundcarboxamide groupalpha-dipeptidesecondary carboxylic acid amideorganic oxygen compoundcyclic alpha peptide1,4-diazinanehydrocarbon derivativeorganic nitrogen compound1,3-dicarbonyl compoundorganooxygen compound |
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