| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:28 UTC |
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| Update Date | 2025-03-25 00:47:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161223 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H21N5O3 |
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| Molecular Mass | 295.1644 |
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| SMILES | NC(Cc1c[nH]cn1)C(=O)N1CCCC1C(=O)NCCO |
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| InChI Key | FFDHXMJIGALYCX-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 | dipeptides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alcohols and polyolsalkanolaminesalpha amino acid amidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesmonoalkylaminesn-acylethanolaminesn-acylpyrrolidinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsproline and derivativespyrrolidinecarboxamidessecondary carboxylic acid amidestertiary carboxylic acid amides |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundn-acylpyrrolidinealpha-amino acid or derivativesorganic oxideimidazoletertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundalkanolamineazoleproline or derivativesalcoholalpha-amino acid amideazacycleheteroaromatic compoundcarboxamide groupn-acylethanolaminealpha-dipeptidesecondary carboxylic acid amidepyrrolidine carboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundpyrrolidine-2-carboxamideorganooxygen compound |
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