| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:23:26 UTC |
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| Update Date | 2025-03-25 01:02:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02254884 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C30H31N5O6 |
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| Molecular Mass | 557.2274 |
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| SMILES | CC1=C(CCC(=O)O)c2cc3[nH]c(cc4nc5cc([nH]c(cc1n2)c(C)c4CCC(=O)O)C(CCC(=O)O)=C5C)[nH]3 |
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| InChI Key | OABAPFINCMABAW-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 | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | carbonyl groupcarboxylic acidazacycleheteroaromatic compoundtricarboxylic acid or derivativesorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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