| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:10:49 UTC |
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| Update Date | 2025-03-24 21:57:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01944820 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C50H56N4O12 |
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| Molecular Mass | 904.3895 |
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| SMILES | C=CC1=C(C)C(=CC2C(C)=C(CCC(=O)O)C(=Cc3[nH]c(Cc4[nH]c(C=C5NC(=O)C(C)=C5C=C)c(C)c4CCC(=O)O)c(CCC(=O)O)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O |
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| InChI Key | NYGKVKYZGKXABR-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 | pentacarboxylic acids and derivatives |
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| Direct Parent | pentacarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolespyrrolinessecondary carboxylic acid amides |
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| Substituents | carbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundcarboxamide grouppentacarboxylic acid or derivativessecondary carboxylic acid amideorganic oxideorganic oxygen compoundpyrrolinepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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