Molecule Identification Common Name [(3,12b-dihydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-14-oxo-docosahydropicen-4-yl)methoxy]sulfonic acid Definition Based on a literature review very few articles have been published on [(3,12b-dihydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-14-oxo-docosahydropicen-4-yl)methoxy]sulfonic acid. Structure CC1(C)CCC2(C)CCC3(C)C4(C)CCC5C(C)(COS(O)(=O)=O)C(O)CCC5(C)C4C(=O)CC3(O)C2C1 InChI=1S/C30H50O7S/c1-24(2)12-13-25(3)14-15-29(7)28(6)11-8-20-26(4,23(28)19(31)16-30(29,33)21(25)17-24)10-9-22(32)27(20,5)18-37-38(34,35)36/h20-23,32-33H,8-18H2,1-7H3,(H,34,35,36) Synonyms Value Source [(3,12b-Dihydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-14-oxo-docosahydropicen-4-yl)methoxy]sulfonate Generator [(3,12b-Dihydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-14-oxo-docosahydropicen-4-yl)methoxy]sulphonate Generator [(3,12b-Dihydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-14-oxo-docosahydropicen-4-yl)methoxy]sulphonic acid Generator
Chemical Formula C30 H50 O7 S Average Molecular Weight 554.78 Monoisotopic Molecular Weight 554.327725124 IUPAC Name [(3,12b-dihydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-14-oxo-docosahydropicen-4-yl)methoxy]sulfonic acid Traditional Name (3,12b-dihydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-14-oxo-tetradecahydropicen-4-yl)methoxysulfonic acid CAS Registry Number Not Available SMILES CC1(C)CCC2(C)CCC3(C)C4(C)CCC5C(C)(COS(O)(=O)=O)C(O)CCC5(C)C4C(=O)CC3(O)C2C1
InChI Identifier InChI=1S/C30H50O7S/c1-24(2)12-13-25(3)14-15-29(7)28(6)11-8-20-26(4,23(28)19(31)16-30(29,33)21(25)17-24)10-9-22(32)27(20,5)18-37-38(34,35)36/h20-23,32-33H,8-18H2,1-7H3,(H,34,35,36)
InChI Key NJNXSTOKVUVDLV-UHFFFAOYSA-N 
