Try beta.chemspider
- 19 of 19 defined stereocentres
(3beta)-28-Hydroxy-23,28-dioxoolean-12-en-3-yl 2-O-beta-D-galactopyranosyl-beta-D-glucopyranosiduronic acid
O=C(O)[C@@]72[C@H](/C1=C/C[C@H]6[C@](C)([C@]1(C)CC2)CC[C@@H]5[C@]6(C)CC[C@H](O[C@@H]4O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]4O[C@@H]3O[C@@H]([C@H](O)[C@H](O)[C@H]3O)CO)[C@]5(C=O)C)CC(C)(C)CC7
InChI=1S/C42H64O15/c1-37(2)13-15-42(36(52)53)16-14-40(5)20(21(42)17-37)7-8-24-38(3)11-10-25(39(4,19-44)23(38)9-12-41(24,40)6)55-35-32(29(48)28(47)31(56-35)33(50)51)57-34-30(49)27(46)26(45)22(18-43)54-34/h7,19,21-32,34-35,43,45-49H,8-18H2,1-6H3,(H,50,51)(H,52,53)/t21-,22+,23+,24+,25-,26-,27-,28-,29-,30+,31-,32+,34-,35+,38-,39-,40+,41+,42-/m0/s1
GBNOIXDJNQHMIV-CHTALKLSSA-N
CSID:8756610, http://www.chemspider.com/Chemical-Structure.8756610.html (accessed 19:36, May 1, 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