| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:38:45 UTC |
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| Update Date | 2025-03-21 17:58:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00012590 |
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| Frequency | 360.0 |
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| Structure | |
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| Chemical Formula | C33H42N4O6 |
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| Molecular Mass | 590.3104 |
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| SMILES | CCC1=C(C)C(=O)NC1CC1=NC(=Cc2[nH]c(CC3NC(=O)C(C)=C3CC)c(C)c2CCC(=O)O)C(CCC(=O)O)=C1C |
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| InChI Key | XSJPWLWWPHHODE-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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