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 00:51:48 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02189512 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C27H46O3 |
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Molecular Mass | 418.3447 |
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SMILES | CC(CCC(=O)O)CC(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C |
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InChI Key | OKDSOOWEGBPRFG-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 | hydroxysteroids |
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Direct Parent | 3-hydroxysteroids |
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Geometric Descriptor | aliphatic homopolycyclic compounds |
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Alternative Parents | carbocyclic fatty acidscarbonyl compoundscarboxylic acidscyclic alcohols and derivativeshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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Substituents | fatty acylcarbocyclic fatty acidcarbonyl groupcarboxylic acidfatty acidcarboxylic acid derivativemedium-chain hydroxy acidaliphatic homopolycyclic compoundorganic oxidemedium-chain fatty acidhydroxy fatty acidalcoholmethyl-branched fatty acid3-hydroxysteroidcyclic alcoholbranched fatty acidmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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