Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:54:30 UTC |
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Update Date | 2025-03-25 00:51:42 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02188761 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C22H34O5 |
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Molecular Mass | 378.2406 |
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SMILES | CC1(C)C(O)CCC2(C)C3C(=O)CC4(C)C(CCC4(O)C(=O)O)C3CCC12 |
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InChI Key | CHYGEZRCVDTTSK-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 | androstane steroids |
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Direct Parent | androgens and derivatives |
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Geometric Descriptor | aliphatic homopolycyclic compounds |
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Alternative Parents | 11-oxosteroids17-hydroxysteroids3-hydroxysteroidsalpha hydroxy acids and derivativescarboxylic acidscyclic alcohols and derivativeshydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidessecondary alcoholstertiary alcohols |
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Substituents | 20-hydroxysteroidcarbonyl groupcarboxylic acidandrogen-skeletonalpha-hydroxy acidcarboxylic acid derivativealiphatic homopolycyclic compoundketoneorganic oxide11-oxosteroid17-hydroxysteroidalcoholoxosteroid3-hydroxysteroidhydroxysteroidhydroxy acidcyclic alcoholtertiary alcoholmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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