| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:31 UTC |
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| Update Date | 2025-03-25 00:58:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232181 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C31H43N5O6 |
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| Molecular Mass | 581.3213 |
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| SMILES | CCC1=C(C)C(Cc2[nH]c(Cc3[nH]c(CC4NN(C)C(=O)C4C)c(C)c3CCC(=O)O)c(CCC(=O)O)c2C)NC1=O |
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| InChI Key | AJRGANAKMTYPQK-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 | dicarboxylic acids and derivatives |
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| Direct Parent | dicarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acid hydrazidescarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrazolidinonespyrrolespyrrolinessecondary carboxylic acid amides |
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| Substituents | carboxylic acid hydrazidecarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundpyrazolidineazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxideorganic oxygen compoundpyrrolinepyrazolidinonepyrroleorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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