camelliasaponin A1

Right Click Jmol Molecule For More Options. Jmol is a free download found Here.
InChI :InChI=1/C58H92O25/c1-10-24(2)48(74)78-34-19-53(3,4)17-26-25-11-12-31-55(7)15-14-33(54(5,6)30(55)13-16-56(31,8)57(25,9)18-32(63)58(26,34)23-61)79-52-45(82-50-41(70)39(68)37(66)29(21-60)77-50)42(71)43(46(83-52)47(72)73)80-51-44(35(64)27(62)22-75-51)81-49-40(69)38(67)36(65)28(20-59)76-49/h10-11,26-46,49-52,59-71H,12-23H2,1-9H3,(H,72,73)/b24-10-
Std.InChI: InChI=1S/C58H92O25/c1-10-24(2)48(74)78-34-19-53(3,4)17-26-25-11-12-31-55(7)15-14-33(54(5,6)30(55)13-16-56(31,8)57(25,9)18-32(63)58(26,34)23-61)79-52-45(82-50-41(70)39(68)37(66)29(21-60)77-50)42(71)43(46(83-52)47(72)73)80-51-44(35(64)27(62)22-75-51)81-49-40(69)38(67)36(65)28(20-59)76-49/h10-11,26-46,49-52,59-71H,12-23H2,1-9H3,(H,72,73)/b24-10-
InChIKey :HEZVPSGPLFBHPM-VROXFSQNBJ
Std.InChIKey: HEZVPSGPLFBHPM-VROXFSQNSA-N
SMILES :C/C=C(/C)\C(=O)OC1CC(CC2C1(C(CC3(C2=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(C(O6)C(=O)O)OC7C(C(C(CO7)O)O)OC8C(C(C(C(O8)CO)O)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)C)C)C)O)CO)(C)C
Molar Refractivity :288.49 ± 0.4 cm3 (est)
Parachor :2414.6 ± 6.0 cm3 (est)
Index of Refraction :1.632 ± 0.03 (est)
Surface Tension :79.6 ± 5.0 dyne/cm (est)
Density :1.47 ± 0.1 g/cm3 (est)
Polarizability :114.37 ± 0.5 10-24cm3 (est)