| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:57:38 UTC |
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| Update Date | 2025-03-25 00:52:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02195804 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C27H44O12 |
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| Molecular Mass | 560.2833 |
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| SMILES | CC12CC(OC3OC(C(=O)O)C(O)C(O)C3O)CCC1CC(O)C1C2C(O)CC2(C)C1CCC2(O)C(O)CO |
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| InChI Key | ZOGUNGBJRIVBKW-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 heteropolycyclic compounds |
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| Alternative Parents | 11-hydroxysteroids17-hydroxysteroids7-hydroxysteroidsacetalsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidscyclic alcohols and derivativesditerpene glycosidesditerpenoidsglucuronic acid derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharideso-glucuronidesorganic oxidesoxacyclic compoundsoxanespregnane steroidsprimary alcoholspyran carboxylic acidssecondary alcoholstertiary alcohols |
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| Substituents | carbonyl groupcarboxylic acidglucuronic acid or derivativesabietane diterpenoido-glucuronidemonosaccharidecarboxylic acid derivativepyran carboxylic acidditerpene glycoside1-o-glucuronidealiphatic heteropolycyclic compoundbeta-hydroxy acidsaccharideorganic oxideacetal21-hydroxysteroidoxaneprimary alcoholorganoheterocyclic compound17-hydroxysteroidalcoholpyran carboxylic acid or derivativesterpene glycosidehydroxy acidcyclic alcohol7-hydroxysteroidoxacycletertiary alcoholmonocarboxylic acid or derivativesorganic oxygen compoundpyransecondary alcoholhydrocarbon derivative11-hydroxysteroidditerpenoidpregnane-skeletonorganooxygen compound |
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