| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:13 UTC |
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| Update Date | 2025-03-25 01:01:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02252175 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H15N3O3 |
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| Molecular Mass | 261.1113 |
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| SMILES | NC(Cc1ccccc1)C(=O)N1CC(=O)NCC1=O |
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| InChI Key | SDDADKOBVFDQSF-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 | cyclic peptides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2,5-dioxopiperazinesalpha amino acid amidesalpha amino acidsamphetamines and derivativesazacyclic compoundsbenzene and substituted derivativescarbonyl compoundscarboxylic acids and derivativesdicarboximidesdipeptideshydrocarbon derivativeslactamsmonoalkylaminesn-substituted carboxylic acid imidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | monocyclic benzene moietycarbonyl grouplactamaromatic heteromonocyclic compoundalpha-amino acid or derivatives2,5-dioxopiperazineorganic oxidedioxopiperazinepiperazineorganonitrogen compoundalpha-amino acidorganopnictogen compounddicarboximidecarboxylic acid imide, n-substitutedorganoheterocyclic compoundamphetamine or derivativesalpha-amino acid amideazacyclecarboxamide groupcarboxylic acid imidealpha-dipeptidesecondary carboxylic acid amideorganic oxygen compoundcyclic alpha peptide1,4-diazinanehydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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