Molecular Formula: C36H53N3O8
Molecular weight: 655.82132
InChi: InChI=1S/C36H53N3O8/c1-20(24-7-8-25-32-26(11-13-36(24,25)3)35(2)12-10-23(41)15-22(35)16-28(32)43)6-9-31(44)46-14-4-5-21-18-39(34(45)38-33(21)37)30-17-27(42)29(19-40)47-30/h18,20,22-30,32,40-43H,6-17,19H2,1-3H3,(H2,37,38,45)/t20-,22+,23-,24-,25+,26+,27+,28-,29-,30-,32+,35+,36-/m1/s1
InChi Key: SEHXPKOZZLPDNC-UHFZWOTRSA-N
SMILES: [C@@]12([C@H]([C@H]3[C@H](CC2)[C@@]2([C@H](C[C@H]3O)C[C@@H](CC2)O)C)CC[C@@H]1[C@@H](CCC(=O)OCC#Cc1cn([C@@H]2O[C@@H]([C@H](C2)O)CO)c(=O)nc1N)C)C
Chemical Name
5-{[(3α,7α-dihydroxy-24-oxo-5β-cholan-24-yl)oxy]prop-1-yn-1-yl}-2'-deoxycytidine
5-{[(3α,7α-dihydroxy-24-oxo-5β-cholan-24-yl)oxy]prop-1-yn-1-yl}-2'-deoxycytidine
Authors of compound