| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:14 UTC |
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| Update Date | 2025-03-25 00:46:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02156314 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C27H33N3O7 |
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| Molecular Mass | 511.2318 |
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| SMILES | Cc1c2[nH]c(c1CCC(=O)O)Cc1[nH]c(c(C)c1CCC(=O)O)Cc1[nH]c(c(CCC(=O)O)c1C)OC2 |
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| InChI Key | FKSBPFLTNLASAO-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 heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspyrroles |
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| Substituents | carbonyl groupethercarboxylic acidazacycleheteroaromatic compoundtricarboxylic acid or derivativesalkyl aryl etheroxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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