- Charge
- 10 of 10 defined stereocentres
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dioxido-tetrahydrofuran-2-yl]methoxy-oxido-phosphoryl] [(2R,3S,4R,5R)-5-[(4S)-4-[5-[(1S)-2-(azepan-1-yl)-2-oxo-1-phenyl-ethyl]-4-thioxo-pyrazolo[3,4-d]pyrimidin-2-yl]-3-carbamoyl-4H-pyridin-1-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl phosphate
c1ccc(cc1)[C@@H](C(=O)N2CCCCCC2)n3cnc4c(c3=S)cn(n4)[C@H]5C=CN(C=C5C(=O)N)[C@H]6[C@@H]([C@@H]([C@H](O6)COP(=O)([O-])OP(=O)([O-])OC[C@@H]7[C@H]([C@H]([C@@H](O7)n8cnc9c8ncnc9N)[O-])[O-])O)O
InChI=1S/C40H46N12O15P2S/c41-33-27-36(44-18-43-33)51(19-45-27)39-32(56)30(54)26(66-39)17-64-69(61,62)67-68(59,60)63-16-25-29(53)31(55)38(65-25)49-13-10-24(22(14-49)34(42)57)52-15-23-35(47-52)46-20-50(40(23)70)28(21-8-4-3-5-9-21)37(58)48-11-6-1-2-7-12-48/h3-5,8-10,13-15,18-20,24-26,28-32,38-39,53,55H,1-2,6-7,11-12,16-17H2,(H2,42,57)(H,59,60)(H,61,62)(H2,41,43,44)/q-2/p-2/t24-,25+,26+,28-,29+,30+,31+,32+,38+,39+/m0/s1
XHBACRZQFHLVAV-LFFSAXSQSA-L
CSID:4451421, http://www.chemspider.com/Chemical-Structure.4451421.html (accessed 07:44, Mar 29, 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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