| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:54:28 UTC |
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| Update Date | 2025-03-24 20:05:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01334165 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C58H78N14O15S3 |
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| Molecular Mass | 1306.4933 |
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| SMILES | CC(C)CC(NC(=O)C1CCCN1C(=O)C1CSSCC(N)C(=O)NC(Cc2ccc(O)cc2)C(=O)SCC(N)C(=O)NC(Cc2ccc(O)cc2)C(=O)NC(Cc2ccccc2)C(=O)NC(CCC(=N)O)C(=O)NC(CC(=N)O)C(=O)N1)C(=O)NCC(N)=O |
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| InChI Key | LGHKROHDKDJIPD-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic polymers |
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| Class | polypeptides |
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| Subclass | polypeptides |
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| Direct Parent | polypeptides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalpha amino acid amidesalpha amino acidsazacyclic compoundsbenzene and substituted derivativescarbonyl compoundscarbothioic s-lactonescarboximidic acidscarboxylic acids and derivativescyclic peptideshydrocarbon derivativeslactamsleucine and derivativesmacrolactamsmonoalkylaminesn-acyl aminesn-acyl-alpha amino acidsn-acylpyrrolidinesorganic disulfidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidesproline and derivativespyrrolidinecarboxamidessecondary carboxylic acid amidestertiary carboxylic acid amidesthioestersthiolactones |
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| Substituents | primary carboxylic acid amidefatty acylcarboximidic acidmonocyclic benzene moietycarbonyl grouplactamaromatic heteromonocyclic compoundfatty amiden-acylpyrrolidine1-hydroxy-2-unsubstituted benzenoidalpha-amino acid or derivativescarboxylic acid derivativemacrolactamorganic oxideleucine or derivativestertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidinethiolactoneorganoheterocyclic compoundn-acyl-alpha amino acid or derivativescarbothioic s-lactoneproline or derivativesthiocarboxylic acid or derivativespolypeptidealpha-amino acid amideazacyclen-acyl-alpha-amino acidthiocarboxylic acid estercarboxamide groupn-acyl-aminen-substituted-alpha-amino acidsecondary carboxylic acid amidepyrrolidine carboxylic acid or derivativesorganic oxygen compoundcyclic alpha peptideorganic disulfidephenolhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundpyrrolidine-2-carboxamideorganooxygen compound |
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