| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:05 UTC |
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| Update Date | 2025-03-25 00:50:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02181009 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C42H42N4O16 |
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| Molecular Mass | 858.2596 |
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| SMILES | O=C(O)CCC1=C2C=C3N=C(C=C(N2)C(CC(=O)O)=C(CCC(=O)O)C2=CC(=NC4=CC(=C1CC(=O)O)C(CCC(=O)O)=C4CCC(=O)O)N2)C(CCC(=O)O)=C3CCC(=O)O |
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| InChI Key | NUXVYEFFWBFJAU-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | imidolactams |
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| Subclass | imidolactams |
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| Direct Parent | imidolactams |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundspyrrolessecondary amines |
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| Substituents | carbonyl groupcarboxylic acidazacycleamino acid or derivativesamino acidheteroaromatic compoundsecondary aminecarboxylic acid derivativeorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactamorganooxygen compoundamine |
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