Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:54:36 UTC |
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Update Date | 2025-03-25 00:51:44 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02189001 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C11H18N4O2 |
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Molecular Mass | 238.143 |
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SMILES | CC(C)CC(NC(=O)Cc1cnc[nH]1)C(N)=O |
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InChI Key | LBAHOAIXSXQXAL-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 | leucine and derivatives |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | alpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesfatty amidesheteroaromatic compoundshydrocarbon derivativesimidazolesn-acyl-alpha amino acidsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidessecondary carboxylic acid amides |
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Substituents | primary carboxylic acid amidefatty acylcarbonyl grouparomatic heteromonocyclic compoundfatty amideorganic oxideimidazoleleucine or derivativesorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundazolen-acyl-alpha amino acid or derivativesazacyclen-acyl-alpha-amino acidheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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