| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:35 UTC |
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| Update Date | 2025-03-21 18:37:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00116595 |
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| Frequency | 22.5 |
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| Structure | |
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| Chemical Formula | C17H19N3O5 |
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| Molecular Mass | 345.1325 |
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| SMILES | O=C(O)C(Cc1c[nH]c2ccccc12)NC(=O)N1CCCC1C(=O)O |
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| InChI Key | JTMCEEDGVVEHHU-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 | n-carbamoyl-alpha amino acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesindolesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsproline and derivativespyrrolespyrrolidine carboxylic acidspyrrolidinecarboxamides |
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| Substituents | carbonyl groupcarboxylic acidindoleorganic oxidearomatic heteropolycyclic compoundpyrrolidine carboxylic acidorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundproline or derivativescarbonic acid derivativeazacyclen-carbamoyl-alpha-amino acidheteroaromatic compoundindole or derivativespyrrolidine carboxylic acid or derivativesorganic oxygen compoundpyrroledicarboxylic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundpyrrolidine-1-carboxamide |
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