- 10 of 10 defined stereocentres
5'-O-{12-[(16beta,17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-16-yl]dodecanoyl}adenosine
C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@@H]([C@@H]2O)CCCCCCCCCCCC(=O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)CCC7=C3C=CC(=C7)O
InChI=1S/C40H57N5O7/c1-40-18-17-28-27-16-14-26(46)19-24(27)13-15-29(28)30(40)20-25(36(40)50)11-9-7-5-3-2-4-6-8-10-12-32(47)51-21-31-34(48)35(49)39(52-31)45-23-44-33-37(41)42-22-43-38(33)45/h14,16,19,22-23,25,28-31,34-36,39,46,48-50H,2-13,15,17-18,20-21H2,1H3,(H2,41,42,43)/t25-,28+,29+,30-,31+,34+,35+,36-,39+,40-/m0/s1
BSSSXFOHTFMIBW-OITWSRPRSA-N
CSID:9896510, http://www.chemspider.com/Chemical-Structure.9896510.html (accessed 19:50, Mar 28, 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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