| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:25 UTC |
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| Update Date | 2025-03-25 00:47:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161109 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H21N3O5S2 |
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| Molecular Mass | 399.0923 |
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| SMILES | NC1CSCSCC(C(=O)O)NC(=O)C(Cc2ccc(O)cc2)NC1=O |
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| InChI Key | MUMHXTXVMDFWGB-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 compoundsbenzene and substituted derivativescarbonyl compoundscarboxylic acidscyclic peptidesdialkylthioethersdithioacetalshydrocarbon derivativeslactamsmacrolactamsmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | monocyclic benzene moietycarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidalpha-amino acid or derivativescarboxylic acid derivativemacrolactamorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundpolypeptideazacycledialkylthioethercarboxamide groupsecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundcyclic alpha peptidethioetherphenolhydrocarbon derivativebenzenoidprimary aliphatic aminethioacetalorganic nitrogen compoundorganooxygen compound |
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