| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:18:19 UTC |
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| Update Date | 2025-03-25 01:00:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02243159 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C31H32N5O6+ |
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| Molecular Mass | 570.2347 |
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| SMILES | C=CC1=C(C)C(=CC2=NC(=Cc3[nH]c(C=C4NC(=O)C(C)=C4C=C)c(C)[n+]3CC(=O)O)C(CCC(=O)O)=C2C)NC1=O |
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| InChI Key | QNZPTEBSSQMEJI-UHFFFAOYSA-O |
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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 | alpha amino acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2,4,5-trisubstituted imidazolesazacyclic compoundscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesketimineslactamsn-substituted imidazolesorganic cationsorganic oxidesorganopnictogen compoundspyrrolinessecondary carboxylic acid amides |
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| Substituents | ketiminecarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundiminealpha-amino acid or derivativesorganic oxideimidazoleorganonitrogen compoundorganopnictogen compoundorganic cationorganoheterocyclic compoundazolen-substituted imidazoleazacycleheteroaromatic compound2,4,5-trisubstituted-imidazolecarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolinetrisubstituted imidazoledicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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