IUPAC Name :(2R,3R,4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bR)-3,10-dihydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
InChI :InChI=1/C30H48O5/c1-25-13-14-29(5)18(19(25)15-27(3,24(34)35)23(33)16-25)7-8-21-26(2)11-10-22(32)28(4,17-31)20(26)9-12-30(21,29)6/h7,19-23,31-33H,8-17H2,1-6H3,(H,34,35)/t19-,20+,21+,22-,23+,25-,26-,27+,28+,29+,30+/m0/s1
Std.InChI: InChI=1S/C30H48O5/c1-25-13-14-29(5)18(19(25)15-27(3,24(34)35)23(33)16-25)7-8-21-26(2)11-10-22(32)28(4,17-31)20(26)9-12-30(21,29)6/h7,19-23,31-33H,8-17H2,1-6H3,(H,34,35)/t19-,20+,21+,22-,23+,25-,26-,27+,28+,29+,30+/m0/s1
InChIKey :ZXWLSOQCDSAYHO-XMINHIMGBK
Std.InChIKey: ZXWLSOQCDSAYHO-XMINHIMGSA-N
SMILES :C[C@@]12CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@]5(C)CO)O)C)C)[C@@H]1C[C@@]([C@@H](C2)O)(C)C(=O)O)C
Molar Refractivity :136.62 ± 0.4 cm3 (est)
Parachor :1109.0 ± 6.0 cm3 (est)
Index of Refraction :1.580 ± 0.03
(est)
Surface Tension :53.5 ± 5.0 dyne/cm (est)
Density :1.19 ± 0.1 g/cm3 (est)
Polarizability :54.16 ± 0.5 10-24cm3 (est)