Try beta.chemspider
- Double-bond stereo
- 14 of 14 defined stereocentres
Methyl (2E)-[(1S,3S,5S,7S,10S,11S,15R,16R,19R,20R,21R,24R,26S,29R)-1,11,16,21-tetrahydroxy-10,20,24,29-tetramethyl-5-(2-methyl-1-propen-1-yl)-9,25-dioxo-4,8,27,28-tetraoxapentacyclo[17.7.1.1~3,7~.1~11 ,15~.0~21,26~]nonacos-13-ylidene]acetate
O=C(OC)\C=C5\C[C@]3(O)O[C@@H]([C@H](O)CC[C@H]1O[C@](O)([C@@H]2C(=O)[C@H](C)CC[C@@]2(O)[C@@H]1C)C[C@@H]4O[C@H](\C=C(/C)C)C[C@H](OC(=O)[C@H]3C)[C@@H]4C)C5
InChI=1S/C36H54O12/c1-18(2)12-24-15-27-20(4)29(45-24)17-36(43)32-31(39)19(3)10-11-34(32,41)21(5)26(47-36)9-8-25(37)28-13-23(14-30(38)44-7)16-35(42,48-28)22(6)33(40)46-27/h12,14,19-22,24-29,32,37,41-43H,8-11,13,15-17H2,1-7H3/b23-14+/t19-,20+,21-,22-,24-,25-,26-,27+,28-,29+,32-,34-,35+,36+/m1/s1
WILYBKPDJRBLGL-QLPHBPGSSA-N
CSID:8434493, http://www.chemspider.com/Chemical-Structure.8434493.html (accessed 02:19, Jul 5, 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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