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- 20 of 22 defined stereocentres
(3beta)-3-{[6-Deoxy-alpha-L-mannopyranosyl-(1->4)-D-glucopyranosyl-(1->2)-(2xi)-alpha-L-erythro-pentopyranosyl]oxy}olean-12-en-28-oic acid
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](OC([C@@H]([C@H]2O)O)OC3[C@H]([C@H](CO[C@H]3O[C@H]4CC[C@]5([C@H](C4(C)C)CC[C@@]6([C@@H]5CC=C7[C@]6(CC[C@@]8([C@H]7CC(CC8)(C)C)C(=O)O)C)C)C)O)O)CO)O)O)O
InChI=1S/C47H76O16/c1-22-30(50)32(52)34(54)38(59-22)62-36-26(20-48)60-39(35(55)33(36)53)63-37-31(51)25(49)21-58-40(37)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34+,35+,36+,37?,38-,39?,40-,44-,45+,46+,47-/m0/s1
CMPXQQJQDODIKN-LPJDNSPBSA-N
CSID:423000, http://www.chemspider.com/Chemical-Structure.423000.html (accessed 19:12, Jul 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
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