Try beta.chemspider
- Double-bond stereo
- 10 of 12 defined stereocentres
4-{[(3beta,5xi,16beta,18xi,21beta,22alpha)-28-Acetoxy-16,22,23-trihydroxy-21-{[(2E)-2-methyl-2-butenoyl]oxy}olean-12-en-3-yl]oxy}-2,2-dimethyl-4-oxobutanoic acid
O=C(O)C(C)(C)CC(=O)O[C@H]4CC[C@@]5([C@@H]1[C@@]([C@]2(\C(=C/C1)C3[C@@]([C@@H](O)C2)([C@@H](O)[C@H](OC(=O)/C(=C/C)C)C(C)(C)C3)COC(=O)C)C)(C)CCC5[C@]4(C)CO)C
InChI=1S/C43H66O11/c1-12-24(2)35(49)54-34-33(48)43(23-52-25(3)45)27(19-37(34,4)5)26-13-14-29-39(8)17-16-31(53-32(47)21-38(6,7)36(50)51)40(9,22-44)28(39)15-18-41(29,10)42(26,11)20-30(43)46/h12-13,27-31,33-34,44,46,48H,14-23H2,1-11H3,(H,50,51)/b24-12+/t27?,28?,29-,30+,31+,33+,34+,39+,40+,41-,42-,43+/m1/s1
SSGATDMHOWZUOC-GTBPOOJBSA-N
CSID:9380050, http://www.chemspider.com/Chemical-Structure.9380050.html (accessed 13:20, Jul 6, 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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