Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:16:35 UTC |
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Update Date | 2025-03-21 18:34:40 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00101954 |
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Frequency | 26.7 |
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Structure | |
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Chemical Formula | C34H36N4O6 |
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Molecular Mass | 596.2635 |
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SMILES | C=CC1=C(C)C(=CC2=NC(=Cc3[nH]c(C=C4NC(=O)C(C)=C4C=C)c(C)c3CCC(=O)OC)C(CCC(=O)O)=C2C)NC1=O |
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InChI Key | XKRCNDUGUMQWEA-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 derivativesdipyrrinsfatty acid estersheteroaromatic compoundshydrocarbon derivativesketimineslactamsmetallotetrapyrrolesmethyl estersorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrrolespyrrolinessecondary carboxylic acid amides |
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Substituents | fatty acylketiminecarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundiminecarboxylic acid derivativepropargyl-type 1,3-dipolar organic compounddipyrrinorganic oxidemethyl esterorganonitrogen compoundorganopnictogen compoundmetallotetrapyrrole skeletonazacycleheteroaromatic compoundorganic 1,3-dipolar compoundcarboxamide groupsecondary carboxylic acid amidefatty acid esterorganic oxygen compoundpyrrolinecarboxylic acid esterbilirubin skeletonpyrroledicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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