| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:36 UTC |
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| Update Date | 2025-03-25 00:56:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02216572 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H28N4O4 |
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| Molecular Mass | 376.2111 |
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| SMILES | CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(CCN)NC1=O |
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| InChI Key | KOLHVLYXAFOTLE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | cyclic peptides |
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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 acids and derivativeshydrocarbon derivativeslactamsmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | monocyclic benzene moietycarbonyl grouplactamaromatic heteromonocyclic compoundazacycle1-hydroxy-2-unsubstituted benzenoidalpha-amino acid or derivativescarboxamide groupsecondary carboxylic acid amideorganic oxideorganic oxygen compoundcyclic alpha peptideorganonitrogen compoundalpha-amino acidorganopnictogen compoundphenolhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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