Molecular Formula: C36H53N3O8
Molecular weight: 655.82132
InChi: InChI=1S/C36H53N3O8/c1-20(25-9-10-26-24-8-7-22-15-23(41)12-13-35(22,2)27(24)16-30(43)36(25,26)3)6-11-32(44)46-14-4-5-21-18-39(34(45)38-33(21)37)31-17-28(42)29(19-40)47-31/h18,20,22-31,40-43H,6-17,19H2,1-3H3,(H2,37,38,45)/t20-,22-,23-,24+,25-,26+,27+,28+,29-,30+,31-,35+,36-/m1/s1
InChi Key: OUGLXXAIOMTMEO-QIMOOFLTSA-N
SMILES: [C@@]12([C@H]([C@H]3[C@H](C[C@@H]2O)[C@@]2([C@H](CC3)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,12α-dihydroxy-24-oxo-5β-cholan-24-yl)oxy]prop-1-yn-1-yl}-2'-deoxycytidine
5-{[(3α,12α-dihydroxy-24-oxo-5β-cholan-24-yl)oxy]prop-1-yn-1-yl}-2'-deoxycytidine
Authors of compound