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- Double-bond stereo
- 5 of 7 defined stereocentres
(5xi,9xi)-27-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]oxy}-3-oxoolean-12-en-28-oic acid
C[C@]12CCC(=O)C(C1CC[C@@]3(C2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)COC(=O)/C=C/c6ccc(c(c6)O)O)C)(C)C
InChI=1S/C39H52O7/c1-34(2)17-18-38(33(44)45)19-20-39(23-46-32(43)12-8-24-7-10-27(40)28(41)21-24)25(26(38)22-34)9-11-30-36(5)15-14-31(42)35(3,4)29(36)13-16-37(30,39)6/h7-10,12,21,26,29-30,40-41H,11,13-20,22-23H2,1-6H3,(H,44,45)/b12-8+/t26-,29?,30?,36-,37+,38-,39-/m0/s1
RHAKBYCTYSBWIE-UIMILTJKSA-N
CSID:57260309, http://www.chemspider.com/Chemical-Structure.57260309.html (accessed 11:30, May 13, 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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