| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:42 UTC |
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| Update Date | 2025-03-21 18:03:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00042605 |
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| Frequency | 80.2 |
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| Structure | |
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| Chemical Formula | C39H66O5 |
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| Molecular Mass | 614.491 |
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| SMILES | CCCCCCC=CCCCCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C3CCC2(O)C(O)CO)C1 |
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| InChI Key | NFNVQGWKEJJQEG-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 | 21-hydroxysteroids |
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| Geometric Descriptor | aliphatic homopolycyclic compounds |
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| Alternative Parents | 17-hydroxysteroidscarbonyl compoundscarboxylic acid esterscyclic alcohols and derivativesdelta-5-steroidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidespregnane steroidsprimary alcoholssecondary alcoholssteroid esterstertiary alcohols |
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| Substituents | delta-5-steroidalcoholcarbonyl groupcyclic alcoholcarboxylic acid derivativesteroid esteraliphatic homopolycyclic compoundtertiary alcoholorganic oxidemonocarboxylic acid or derivativesorganic oxygen compound21-hydroxysteroidcarboxylic acid estersecondary alcoholhydrocarbon derivativeprimary alcoholpregnane-skeletonorganooxygen compound17-hydroxysteroid |
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