ESTERASTIN

67655-93-0

MFCD01664802

C28 H46 N2 O6

506.679

InChI=1S/C28H46N2O6/c1-4-6-8-10-11-12-13-14-15-17-22(35-28(34)24(20-26(29)32)30-21(3)31)19-25-23(27(33)36-25)18-16-9-7-5-2/h11-12,14-15,22-25H,4-10,13,16-20H2,1-3H3,(H2,29,32)(H,30,31)/b12-11-,15-14-/t22-,23-,24-,25-/m0/s1

InChIKey=JKNGELGDDBUFHG-JJPNXARGSA-N

CCCCCC[C@H]1[C@@H](OC1=O)C[C@H](C/C=C\C/C=C\CCCCC)OC(=O)[C@H](CC(=O)N)NC(=O)C

氢键供体数量:2

氢键受体数量:8

XLogP3:4.0

Bulk/Fine:F