| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:45:23 UTC |
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| Update Date | 2025-03-25 00:48:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02167909 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C36H62O8 |
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| Molecular Mass | 622.4445 |
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| SMILES | CC(C)CCCC(C)C1CCC2C1(C)CC(O)C1C3(C)CCC(OC4OC(C(=O)O)C(O)C(O)C4O)C(C)(C)C3CCC21C |
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| InChI Key | UQVFDWPRJLBTDN-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-hydroxysteroidsacetalsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidscholesterols and derivativescyclic alcohols and derivativesglucuronic acid derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharideso-glucuronidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcoholstriterpene glycosidestriterpenoids |
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| Substituents | polycyclic triterpenoidcarbonyl groupcarboxylic acidglucuronic acid or derivativeso-glucuronidemonosaccharidecarboxylic acid derivativepyran carboxylic acidtriterpene glycoside1-o-glucuronidealiphatic heteropolycyclic compoundtriterpenoidbeta-hydroxy acidsaccharideorganic oxideacetaloxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativeshydroxysteroidterpene glycosidehydroxy acidcyclic alcoholcholesteroloxacyclemonocarboxylic acid or derivativesorganic oxygen compoundpyransecondary alcoholsteroid-glucuronide-skeletonhydrocarbon derivative11-hydroxysteroidcholestane-skeletonorganooxygen compound |
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