Try beta.chemspider
- Double-bond stereo
- 8 of 9 defined stereocentres
(12alpha,24E)-28-{[(3S)-4-Carboxy-3-hydroxy-3-methylbutanoyl]oxy}-12-hydroxy-3,7,11,15-tetraoxolanosta-8,24-dien-26-oic acid
C/C(=C\CC[C@@H](C)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)[C@H](O)[C@@]21C)[C@@]1(C)CCC(=O)[C@@](C)(COC(=O)C[C@@](C)(O)CC(O)=O)[C@@H]1CC3=O)/C(O)=O
InChI=1S/C36H48O12/c1-18(9-8-10-19(2)31(45)46)20-13-24(39)36(7)27-21(37)14-22-33(4,28(27)29(43)30(44)35(20,36)6)12-11-23(38)34(22,5)17-48-26(42)16-32(3,47)15-25(40)41/h10,18,20,22,30,44,47H,8-9,11-17H2,1-7H3,(H,40,41)(H,45,46)/b19-10+/t18-,20?,22-,30+,32+,33+,34+,35+,36+/m1/s1
KQPHEVLEJQGFTM-RBNLKONBSA-N
CSID:129163706, http://www.chemspider.com/Chemical-Structure.129163706.html (accessed 20:32, Jul 15, 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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