Try beta.chemspider
- 14 of 16 defined stereocentres
(1alpha,3beta,5xi,9xi)-23-[(3,4-Di-O-acetyl-6-deoxy-beta-D-gulopyranosyl)oxy]-1,3-dihydroxyolean-12-en-29-oic acid
C[C@@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@]2([C@H](C[C@@H]([C@]3(C2CC[C@@]4(C3CC=C5[C@]4(CC[C@@]6([C@H]5C[C@](CC6)(C)C(=O)O)C)C)C)C)O)O)C)O)OC(=O)C)OC(=O)C
InChI=1S/C40H62O11/c1-21-31(50-22(2)41)32(51-23(3)42)30(45)33(49-21)48-20-37(6)26-12-13-39(8)27(40(26,9)29(44)18-28(37)43)11-10-24-25-19-36(5,34(46)47)15-14-35(25,4)16-17-38(24,39)7/h10,21,25-33,43-45H,11-20H2,1-9H3,(H,46,47)/t21-,25+,26?,27?,28+,29+,30-,31+,32+,33-,35-,36-,37+,38-,39-,40+/m1/s1
PNIWMDGKYRCTQD-SIWOOLDQSA-N
CSID:4884796, http://www.chemspider.com/Chemical-Structure.4884796.html (accessed 04:22, Jul 8, 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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