| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:46:43 UTC |
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| Update Date | 2025-03-25 00:27:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02030537 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C49H54N6O9 |
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| Molecular Mass | 870.3952 |
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| SMILES | C=CC1=C(C)C(=CC2=NC(=Cc3c(CC4NC(=O)C(C)=C4CC)[nH]c(Cc4[nH]c(C=C5NC(=O)C(C)=C5C=C)c(C)c4CCC(=O)O)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O |
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| InChI Key | KNHVPYXAEAGFLF-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 | tetrapyrroles and derivatives |
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| Subclass | bilirubins |
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| Direct Parent | bilirubins |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesketimineslactamsmetallotetrapyrrolesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrrolespyrrolinessecondary carboxylic acid amidestricarboxylic acids and derivatives |
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| Substituents | ketiminecarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundiminetricarboxylic acid or derivativescarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundorganic oxideorganonitrogen compoundorganopnictogen compoundmetallotetrapyrrole skeletonazacycleheteroaromatic compoundorganic 1,3-dipolar compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolinebilirubin skeletonpyrrolehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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