| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:13 UTC |
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| Update Date | 2025-03-25 00:50:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02181323 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C40H38N4O16 |
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| Molecular Mass | 830.2283 |
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| SMILES | O=C(O)CCc1c2nc3c(CC(=O)O)c(CCC(=O)O)c4cc(nc([nH]c(c(CC(=O)O)c4CCC(=O)O)C=3)C=c3[nH]c(c(CC(=O)O)c3CCC(=O)O)=C2)c1CC(=O)O |
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| InChI Key | TVNWUGCZARHBID-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 | heteroaromatic compounds |
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| Subclass | heteroaromatic compounds |
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| Direct Parent | heteroaromatic compounds |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrroles |
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| Substituents | carbonyl groupcarboxylic acidazacycleheteroaromatic compoundcarboxylic acid derivativeorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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