Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:57 UTC |
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Update Date | 2025-03-21 18:35:22 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00105303 |
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Frequency | 25.7 |
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Structure | |
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Chemical Formula | C27H42O9 |
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Molecular Mass | 510.2829 |
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SMILES | CC12CC(O)C3C(CCC4C(C)(C)C(OC5OC(C(=O)O)C(O)C(O)C5O)CCC34C)C1CCC2=O |
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InChI Key | CEVGBZIULYYMCO-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 | steroidal glycosides |
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Direct Parent | steroid glucuronide conjugates |
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Geometric Descriptor | aliphatic heteropolycyclic compounds |
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Alternative Parents | 11-hydroxysteroids17-oxosteroidsacetalsandrostane steroidsbeta hydroxy acids and derivativescarboxylic acidscyclic alcohols and derivativesglucuronic acid derivativeshydrocarbon derivativesketonesmonocarboxylic acids and derivativesmonosaccharideso-glucuronidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcohols |
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Substituents | carbonyl groupcarboxylic acidglucuronic acid or derivativeso-glucuronidemonosaccharidecarboxylic acid derivativepyran carboxylic acidketone1-o-glucuronidealiphatic heteropolycyclic compoundbeta-hydroxy acidsaccharideorganic oxideacetaloxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativesoxosteroidhydroxysteroidhydroxy acidcyclic alcoholoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundandrostane-skeletonpyransecondary alcoholsteroid-glucuronide-skeleton17-oxosteroidhydrocarbon derivative11-hydroxysteroidorganooxygen compound |
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