STROPHANTHIDIN-3-NICOTINATE

21515-43-5

MFCD01740221

C29 H35 N O7

509.595

InChI=1S/C29H35NO7/c1-26-8-5-22-23(29(26,35)11-7-21(26)19-13-24(32)36-16-19)6-10-28(34)14-20(4-9-27(22,28)17-31)37-25(33)18-3-2-12-30-15-18/h2-3,12-13,15,17,20-23,34-35H,4-11,14,16H2,1H3/t20-,21+,22-,23+,26+,27-,28-,29-/m0/s1

InChIKey=KZDOGGYMASNQGM-SBQWKNPYSA-N

C[C@]12CC[C@H]3[C@H]([C@]1(CC[C@@H]2C4=CC(=O)OC4)O)CC[C@]5([C@@]3(CC[C@@H](C5)OC(=O)c6cccnc6)C=O)O

氢键供体数量:2

氢键受体数量:8

XLogP3:1.0

Bulk/Fine:F