| 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 | DMID02189525 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C27H43NO3 |
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| Molecular Mass | 429.3243 |
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| SMILES | CC(CCC(=O)NCC(=O)O)C1CCC2C3CCC4=C(CCCC4(C)C)C3CCC12C |
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| InChI Key | IEBFJWBAIIAXRI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | steroids and steroid derivatives |
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| Subclass | pregnane steroids |
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| Direct Parent | pregnane steroids |
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| Geometric Descriptor | aliphatic homopolycyclic compounds |
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| Alternative Parents | acyl glycinesalpha amino acidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesn-acyl aminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidfatty amidealpha-amino acid or derivativescarboxylic acid derivativealiphatic homopolycyclic compoundorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundn-acyl-alpha amino acid or derivativesn-acyl-alpha-amino acidcarboxamide groupn-acyl-aminen-acylglycinesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundpregnane-skeletonorganooxygen compound |
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