| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:12:51 UTC |
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| Update Date | 2025-03-25 00:58:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02230644 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H15N3O |
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| Molecular Mass | 205.1215 |
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| SMILES | CN1C(C(N)=O)CCC1c1cccnc1 |
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| InChI Key | NILNZJRCICEFQO-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 | alkaloids and derivativesalpha amino acid amidesalpha amino acidsaralkylaminesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesn-alkylpyrrolidinesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidespyrrolidinecarboxamidespyrrolidinylpyridinestrialkylamines |
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| Substituents | primary carboxylic acid amidecarbonyl grouparomatic heteromonocyclic compoundpyrrolidinylpyridinearalkylamineorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidinetertiary amineorganoheterocyclic compoundproline or derivativesalpha-amino acid amideazacyclen-alkylpyrrolidineheteroaromatic compoundtertiary aliphatic aminemethylpyridinecarboxamide groupalkaloid or derivativespyridinepyrrolidine carboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidine-2-carboxamideamineorganooxygen compound |
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