Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 08:49:28 UTC |
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Update Date | 2025-03-25 00:25:56 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01321964 |
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Frequency | 1.0 |
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Structure | |
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Chemical Formula | C49H73N15O11S2 |
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Molecular Mass | 1111.5055 |
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SMILES | CCC(C)C(NC(=O)C(N)CCCNC(=N)N)NC(=O)C1CCCN1C(=O)C1CSSCC(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 |
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InChI Key | JPSLDZRNWXRENF-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 acidsarginine and derivativesazacyclic compoundsbenzene and substituted derivativescarbonyl compoundscarboximidamidescarboximidic acidscarboxylic acids and derivativescyclic peptidesguanidineshydrocarbon derivativesimineslactamsmacrolactamsmonoalkylaminesn-acyl aminesn-acylpyrrolidinesorganic disulfidesorganic oxidesorganopnictogen compoundsproline and derivativespyrrolidinecarboxamidessecondary carboxylic acid amidestertiary carboxylic acid amides |
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Substituents | fatty acylcarboximidic acidmonocyclic benzene moietycarbonyl grouplactamaromatic heteromonocyclic compoundguanidineiminefatty amiden-acylpyrrolidine1-hydroxy-2-unsubstituted benzenoidalpha-amino acid or derivativescarboxylic acid derivativemacrolactamorganic oxidearginine or derivativestertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundproline or derivativespolypeptidealpha-amino acid amideazacyclecarboximidamidecarboxamide groupn-acyl-aminesecondary carboxylic acid amidepyrrolidine carboxylic acid or derivativesorganic oxygen compoundcyclic alpha peptideorganic disulfidephenolhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundpyrrolidine-2-carboxamideorganooxygen compound |
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