| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:57 UTC |
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| Update Date | 2025-03-25 00:56:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02217420 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C27H44O8 |
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| Molecular Mass | 496.3036 |
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| SMILES | CC(=O)C1CCC2C3CCC4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CC(O)C12C |
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| InChI Key | QCNOFMVDNQSWTJ-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 | steroidal glycosides |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | 12-hydroxysteroids20-oxosteroidsacetalscyclic alcohols and derivativeshydrocarbon derivativesketonesmonosaccharidesorganic oxidesoxacyclic compoundsoxanespregnane steroidsprimary alcoholssecondary alcohols |
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| Substituents | carbonyl group12-hydroxysteroidsteroidal glycosidemonosaccharide20-oxosteroidketonealiphatic heteropolycyclic compoundsaccharideorganic oxideacetaloxaneprimary alcoholorganoheterocyclic compoundalcoholoxosteroidhydroxysteroidcyclic alcoholoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativepregnane-skeletonorganooxygen compound |
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