Try beta.chemspider
- Double-bond stereo
- 6 of 9 defined stereocentres
(5xi,9xi,18xi,22beta)-24-Hydroxy-22-{[(2Z)-2-methyl-2-butenoyl]oxy}-3-oxoolean-12-en-28-oic acid
O=C4[C@@](CO)(C)C5CC[C@@]1(C(C/C=C2\[C@]1(CC[C@@]3(C(=O)O)[C@H](OC(=O)\C(=C/C)C)CC(C)(C)CC23)C)[C@@]5(C)CC4)C
InChI=1S/C35H52O6/c1-9-21(2)28(38)41-27-19-30(3,4)18-23-22-10-11-25-31(5)14-13-26(37)32(6,20-36)24(31)12-15-34(25,8)33(22,7)16-17-35(23,27)29(39)40/h9-10,23-25,27,36H,11-20H2,1-8H3,(H,39,40)/b21-9-/t23?,24?,25?,27-,31+,32-,33-,34-,35+/m1/s1
NZQARWYKOBSGNY-QOJGYTGKSA-N
CSID:8161034, http://www.chemspider.com/Chemical-Structure.8161034.html (accessed 09:07, Apr 26, 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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