| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:17 UTC |
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| Update Date | 2025-03-25 00:47:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02163105 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C43H50N2O9 |
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| Molecular Mass | 738.3516 |
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| SMILES | C=CC1=C(C)C(=Cc2[nH]c(Cc3[nH]c(C=C4C(CCC(=O)O)=C(C)C(C)=C4CCC(=O)O)c(C)c3CCC(=O)O)c(CCC(=O)O)c2C)C(C)=C(C)C1=O |
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| InChI Key | YMSKORDVNUBDOG-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 | tetracarboxylic acids and derivatives |
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| Direct Parent | tetracarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsp-quinomethanesp-quinonespyrroles |
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| Substituents | carbonyl groupcarboxylic acidaromatic heteromonocyclic compoundazacyclep-quinoneheteroaromatic compoundtetracarboxylic acid or derivativescyclic ketonequinomethaneketoneorganic oxideorganic oxygen compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundp-quinomethaneorganoheterocyclic compoundorganooxygen compoundquinone |
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