| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:16 UTC |
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| Update Date | 2025-03-25 00:49:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02172208 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H18N4O |
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| Molecular Mass | 222.1481 |
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| SMILES | CN1CCCC1C(=O)NCc1cncn1C |
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| InChI Key | ITXPVDLFIGUNFF-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 | proline and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesn-alkylpyrrolidinesn-substituted imidazolesorganic oxidesorganopnictogen compoundspyrrolidinecarboxamidessecondary carboxylic acid amidestrialkylamines |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundorganic oxideimidazoleorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidinetertiary amineorganoheterocyclic compoundazolen-substituted imidazoleproline or derivativesalpha-amino acid amideazacyclen-alkylpyrrolidineheteroaromatic compoundtertiary aliphatic aminecarboxamide groupsecondary carboxylic acid amidepyrrolidine carboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidine-2-carboxamideamineorganooxygen compound |
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