| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:08:26 UTC |
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| Update Date | 2025-03-24 20:11:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01367496 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C51H69N7O12S2 |
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| Molecular Mass | 1035.4446 |
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| SMILES | CCC1C(Cc2c(C)c(CCC(=O)O)c(Cc3[nH]c(CC4CSSCC(N)C(=O)NC(Cc5ccc(O)cc5)C(=O)NC(CCC(=N)O)C(=O)N4)c(C)c3CCC(=O)O)c(C)c2CCC(=O)O)NC(=O)C1C |
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| InChI Key | YCNNPWAJJYOVTG-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 acidsazacyclic compoundscarbonyl compoundscarboximidic acidscarboxylic acidscyclic peptidesheteroaromatic compoundshydrocarbon derivativeslactamsmonoalkylaminesorganic disulfidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsphenylpropanoic acidspyrrolespyrrolidine-2-onessecondary carboxylic acid amidestricarboxylic acids and derivativesp-xylenes |
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| Substituents | 2-pyrrolidonecarboximidic acidmonocyclic benzene moietycarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compound3-phenylpropanoic-acid1-hydroxy-2-unsubstituted benzenoidtricarboxylic acid or derivativesalpha-amino acid or derivativescarboxylic acid derivativexyleneorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidinepyrrolidoneorganoheterocyclic compoundpolypeptideazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amidep-xyleneorganic oxygen compoundcyclic alpha peptideorganic disulfidepyrrolephenolhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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