| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:15 UTC |
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| Update Date | 2025-03-25 00:55:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02211153 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H16N4O2 |
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| Molecular Mass | 236.1273 |
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| SMILES | CC(=O)N1CCCC1C(=O)NCc1cnc[nH]1 |
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| InChI Key | CFSSDDOPIHKIKU-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 | acetamidesalpha amino acid amidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesn-acylpyrrolidinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolidinecarboxamidessecondary carboxylic acid amidestertiary carboxylic acid amides |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundn-acylpyrrolidineorganic oxideimidazoletertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundacetamideazoleproline or derivativesalpha-amino acid amideazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amidepyrrolidine carboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidine-2-carboxamideorganooxygen compound |
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