- 19 of 21 defined stereocentres
(3beta,4alpha,8xi,9beta,16alpha,17beta)-16-Hydroxy-4-(hydroxymethyl)-4,14-dimethyl-17-{(1S)-1-[(2R)-4-methyl-6-oxo-5,6-dihydro-2H-pyran-2-yl]ethyl}-9,19-cycloandrostan-3-yl 2-O-beta-D-glucopyranosyl-a lpha-L-arabinopyranoside
O=C1O[C@@H](/C=C(/C)C1)[C@@H](C)[C@H]8[C@H](O)C[C@]4(C)[C@]8(C)CC[C@]57C[C@@]76CC[C@H](O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@](C)(CO)C6CCC45
InChI=1S/C41H64O14/c1-19-12-23(52-28(46)13-19)20(2)29-21(44)14-39(5)26-7-6-25-37(3,18-43)27(8-9-40(25)17-41(26,40)11-10-38(29,39)4)54-36-34(30(47)22(45)16-51-36)55-35-33(50)32(49)31(48)24(15-42)53-35/h12,20-27,29-36,42-45,47-50H,6-11,13-18H2,1-5H3/t20-,21-,22+,23+,24-,25?,26?,27+,29+,30+,31-,32+,33-,34-,35+,36+,37+,38-,39+,40-,41+/m1/s1
VBUXPFNXINACSV-BVYADCSKSA-N
CSID:8277301, http://www.chemspider.com/Chemical-Structure.8277301.html (accessed 05:08, Apr 20, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
Advertisement
Spotlight