Try beta.chemspider
- Double-bond stereo
- 7 of 9 defined stereocentres
(2S,4R,9beta,16alpha,17xi,20xi,23E)-25-Acetoxy-2,20-dihydroxy-9,10,14-trimethyl-1,11,22-trioxo-4,9-cyclo-9,10-secocholesta-5,23-dien-16-yl (9Z)-9-octadecenoate
CC(=O)OC(C)(C)/C=C/C(=O)C(C)(O)C1[C@@H](C[C@@]2(C)[C@@H]3CC=C4[C@@H](C[C@H](O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@@]21C)OC(=O)CCCCCCC/C=C\CCCCCCCC
InChI=1S/C50H78O9/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-42(55)58-38-32-47(7)39-28-27-35-36(31-37(52)44(56)46(35,5)6)49(39,9)41(54)33-48(47,8)43(38)50(10,57)40(53)29-30-45(3,4)59-34(2)51/h18-19,27,29-30,36-39,43,52,57H,11-17,20-26,28,31-33H2,1-10H3/b19-18-,30-29+/t36-,37+,38-,39+,43?,47+,48-,49+,50?/m1/s1
OBAIMZMTBKKNFQ-ZAGVHFGVSA-N
CSID:78436570, http://www.chemspider.com/Chemical-Structure.78436570.html (accessed 14:16, Jul 7, 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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