| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:53 UTC |
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| Update Date | 2025-03-25 00:56:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02217245 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H18N4O5 |
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| Molecular Mass | 358.1277 |
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| SMILES | O=C(CCC1NC(=O)NC1=O)NC(Cc1c[nH]c2ccccc12)C(=O)O |
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| InChI Key | IUHQXQOCMCMRLK-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 acidsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidsdicarboximidesfatty amidesheteroaromatic compoundshydantoinshydrocarbon derivativesimidazolidinonesindolesmonocarboxylic acids and derivativesn-acyl-alpha amino acidsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolessecondary carboxylic acid amides |
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| Substituents | imidazolidinefatty acylcarbonyl groupcarboxylic acidindolefatty amidealpha-amino acid or derivativesimidazolidinoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compounddicarboximideorganoheterocyclic compoundn-acyl-alpha amino acid or derivativescarbonic acid derivativeazacyclen-acyl-alpha-amino acidheteroaromatic compoundindole or derivativescarboxamide groupalpha-dipeptidesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydantoinpyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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