Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:36:13 UTC |
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Update Date | 2025-03-21 17:57:15 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00006619 |
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Frequency | 777.4 |
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Structure | |
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Chemical Formula | C33H40N4O6 |
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Molecular Mass | 588.2948 |
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SMILES | C=CC1=C(C)C(Cc2[nH]c(C=C3N=C(CC4NC(=O)C(CC)=C4C)C(C)=C3CCC(=O)O)c(CCC(=O)O)c2C)NC1=O |
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InChI Key | RYBHHHWFFOBQII-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 acidsdicarboxylic acids and derivativesdipyrrinsheteroaromatic compoundshydrocarbon derivativesketimineslactamsmetallotetrapyrrolesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrrolespyrrolinessecondary carboxylic acid amides |
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Substituents | ketiminecarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundiminecarboxylic acid derivativepropargyl-type 1,3-dipolar organic compounddipyrrinorganic oxideorganonitrogen compoundorganopnictogen compoundmetallotetrapyrrole skeletonazacycleheteroaromatic compoundorganic 1,3-dipolar compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolinebilirubin skeletonpyrroledicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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