Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:54:49 UTC |
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Update Date | 2025-03-25 00:51:49 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02189519 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C26H41NO4 |
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Molecular Mass | 431.3036 |
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SMILES | CC(CCC(=O)NCC(=O)O)C1CCC2C3CCC4=C(CC(O)C4(C)C)C3CCC12C |
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InChI Key | AXIJPRWXHNSCDJ-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 | acyl glycines |
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Geometric Descriptor | aliphatic homopolycyclic compounds |
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Alternative Parents | alpha amino acidscarbonyl compoundscarboxylic acidscyclic alcohols and derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesn-acyl aminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary alcoholssecondary carboxylic acid amides |
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Substituents | fatty acylcarbonyl groupcarboxylic acidfatty amidealiphatic homopolycyclic compoundorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundalcoholcyclic alcoholcarboxamide groupn-acyl-aminen-acylglycinesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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