N-(PYROGLYTAMYLHISTIDYLPROLYL-6-AMINOHEXANOYL)AZA-15-CROWN-5 HYDROCHLORIDE

145594-43-0

MFCD01756718

C32 H51 N7 O9 . Cl H

714.256

InChI=1S/C32H51N7O9.ClH/c40-28-8-7-25(36-28)30(42)37-26(21-24-22-33-23-35-24)32(44)39-10-4-5-27(39)31(43)34-9-3-1-2-6-29(41)38-11-13-45-15-17-47-19-20-48-18-16-46-14-12-38;/h22-23,25-27H,1-21H2,(H,33,35)(H,34,43)(H,36,40)(H,37,42);1H/t25-,26-,27-;/m0./s1

InChIKey=XTKNOKBTXPGCIS-JCVJZEPNSA-N

c1c(nc[nH]1)C[C@@H](C(=O)N2CCC[C@H]2C(=O)NCCCCCC(=O)N3CCOCCOCCOCCOCC3)NC(=O)[C@@H]4CCC(=O)N4.Cl

pro_donors:4

pro_acceptors:16

XLogP3:0.0

Bulk/Fine:F