Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:55:28 UTC |
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Update Date | 2025-03-25 00:52:01 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02190923 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C34H34N4O4 |
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Molecular Mass | 562.258 |
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SMILES | C=CC1=C(C)c2cc3[nH]c(cc4nc5cc([nH]c(cc1n2)c(CCC(=O)O)c4C)C(CCC(=O)O)=C5C)c(C)c3C=C |
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InChI Key | MAHIWPBECJZRTR-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 heteropolycyclic compounds |
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Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrroles |
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Substituents | carbonyl groupcarboxylic acidazacycleheteroaromatic compoundorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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