| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:16:10 UTC |
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| Update Date | 2025-03-21 18:34:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00100890 |
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| Frequency | 27.1 |
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| Structure | |
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| Chemical Formula | C31H40N4O7 |
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| Molecular Mass | 580.2897 |
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| SMILES | CCC1=C(C)C(=O)NC1Cc1[nH]c(Cc2[nH]c(CC3NC(=O)C(C)=C3O)c(C)c2CCC(=O)O)c(CCC(=O)O)c1C |
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| InChI Key | BTYNGIAVXGPKJI-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 derivativesheteroaromatic compoundshydrocarbon derivativeslactamsmetallotetrapyrrolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolespyrrolinessecondary carboxylic acid amidesvinylogous acids |
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| Substituents | carbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundcarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundmetallotetrapyrrole skeletonazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amidevinylogous acidorganic oxygen compoundpyrrolinebilirubin skeletonpyrroledicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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