| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:41 UTC |
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| Update Date | 2025-03-25 00:58:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232576 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C27H36N2O8 |
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| Molecular Mass | 516.2472 |
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| SMILES | CCC1C(Cc2[nH]c(Cc3oc(CC(=O)O)c(C)c3CCC(=O)O)c(CCC(=O)O)c2C)NC(=O)C1C |
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| InChI Key | UWDOYJCXWBYENZ-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 | tricarboxylic acids and derivatives |
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| Direct Parent | tricarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsfuransheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspyrrolespyrrolidine-2-onessecondary carboxylic acid amides |
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| Substituents | furan2-pyrrolidonecarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundtricarboxylic acid or derivativesorganic oxideorganonitrogen compoundorganopnictogen compoundpyrrolidinepyrrolidoneorganoheterocyclic compoundazacycleheteroaromatic compoundcarboxamide groupoxacyclesecondary carboxylic acid amideorganic oxygen compoundpyrrolehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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