basellasaponin C

Right Click Jmol Molecule For More Options. Jmol is a free download found Here.
InChI :InChI=1/C47H68O22/c1-41(2)13-15-46(39(61)68-35-29(53)28(52)27(51)22(18-48)64-35)16-14-43(4)20(21(46)17-41)7-8-23-42(3)11-10-25(45(6,37(57)58)24(42)9-12-44(23,43)5)65-36-30(54)31-32(33(66-36)34(55)56)69-47(62,38(59)60)40(67-31)63-19-26(49)50/h7,21-25,27-33,35-36,40,48,51-54,62H,8-19H2,1-6H3,(H,49,50)(H,55,56)(H,57,58)(H,59,60)/t21-,22+,23+,24+,25-,27+,28-,29+,30+,31+,32-,33-,35-,36+,40-,42+,43+,44+,45-,46-,47-/m0/s1
Std.InChI: InChI=1S/C47H68O22/c1-41(2)13-15-46(39(61)68-35-29(53)28(52)27(51)22(18-48)64-35)16-14-43(4)20(21(46)17-41)7-8-23-42(3)11-10-25(45(6,37(57)58)24(42)9-12-44(23,43)5)65-36-30(54)31-32(33(66-36)34(55)56)69-47(62,38(59)60)40(67-31)63-19-26(49)50/h7,21-25,27-33,35-36,40,48,51-54,62H,8-19H2,1-6H3,(H,49,50)(H,55,56)(H,57,58)(H,59,60)/t21-,22+,23+,24+,25-,27+,28-,29+,30+,31+,32-,33-,35-,36+,40-,42+,43+,44+,45-,46-,47-/m0/s1
InChIKey :CSVNFXHGUWHHIF-XDDIMSPDBL
Std.InChIKey: CSVNFXHGUWHHIF-XDDIMSPDSA-N
SMILES :C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)C)(C)C(=O)O)O[C@H]7[C@@H]([C@@H]8[C@@H]([C@H](O7)C(=O)O)O[C@]([C@H](O8)OCC(=O)O)(C(=O)O)O)O
Molar Refractivity :230.87 ± 0.4 cm3 (est)
Parachor :1942.9 ± 6.0 cm3 (est)
Index of Refraction :1.637 ± 0.03 (est)
Surface Tension :83.3 ± 5.0 dyne/cm (est)
Density :1.53 ± 0.1 g/cm3 (est)
Polarizability :91.52 ± 0.5 10-24cm3 (est)