Molecule Identification Common Name [6-hydroxy-1,1,4a-trimethyl-10-oxo-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthren-9-yl]oxidanesulfonic acid Definition Based on a literature review very few articles have been published on [6-hydroxy-1,1,4a-trimethyl-10-oxo-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthren-9-yl]oxidanesulfonic acid. Structure CC(C)C1=C(O)C=C2C(=C1)C(OS(O)(=O)=O)C(=O)C1C(C)(C)CCCC21C InChI=1S/C20H28O6S/c1-11(2)12-9-13-14(10-15(12)21)20(5)8-6-7-19(3,4)18(20)16(22)17(13)26-27(23,24)25/h9-11,17-18,21H,6-8H2,1-5H3,(H,23,24,25) Synonyms Value Source [6-Hydroxy-1,1,4a-trimethyl-10-oxo-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthren-9-yl]oxidanesulfonate Generator [6-Hydroxy-1,1,4a-trimethyl-10-oxo-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthren-9-yl]oxidanesulphonate Generator [6-Hydroxy-1,1,4a-trimethyl-10-oxo-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthren-9-yl]oxidanesulphonic acid Generator
Chemical Formula C20 H28 O6 S Average Molecular Weight 396.5 Monoisotopic Molecular Weight 396.160659796 IUPAC Name [6-hydroxy-1,1,4a-trimethyl-10-oxo-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthren-9-yl]oxidanesulfonic acid Traditional Name (6-hydroxy-7-isopropyl-1,1,4a-trimethyl-10-oxo-3,4,9,10a-tetrahydro-2H-phenanthren-9-yl)oxidanesulfonic acid CAS Registry Number Not Available SMILES CC(C)C1=C(O)C=C2C(=C1)C(OS(O)(=O)=O)C(=O)C1C(C)(C)CCCC21C
InChI Identifier InChI=1S/C20H28O6S/c1-11(2)12-9-13-14(10-15(12)21)20(5)8-6-7-19(3,4)18(20)16(22)17(13)26-27(23,24)25/h9-11,17-18,21H,6-8H2,1-5H3,(H,23,24,25)
InChI Key LPIYWGHYLMRDMD-UHFFFAOYSA-N 
