| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:15 UTC |
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| Update Date | 2025-03-21 18:02:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00039115 |
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| Frequency | 89.1 |
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| Structure | |
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| Chemical Formula | C16H20N4O2 |
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| Molecular Mass | 300.1586 |
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| SMILES | NC(=O)C1CCCN1C(=O)C(N)Cc1c[nH]c2ccccc12 |
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| InChI Key | ARYURGXPFZJASG-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 | dipeptides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesindolesmonoalkylaminesn-acylpyrrolidinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidesproline and derivativespyrrolespyrrolidinecarboxamidestertiary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidecarbonyl groupindolen-acylpyrrolidinealpha-amino acid or derivativesorganic oxidearomatic heteropolycyclic compoundtertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundproline or derivativesalpha-amino acid amideazacycleheteroaromatic compoundindole or derivativescarboxamide groupalpha-dipeptidepyrrolidine carboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundpyrrolidine-2-carboxamideorganooxygen compound |
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