GLY-ALA-PRO-VAL-PRO-TYR-PRO-ASP-PRO-LEU-GLU-PRO-ARG

120944-72-1

MFCD00133727

C66 H98 N16 O21

1451.59

InChI=1S/C66H98N16O21/c1-33(2)28-40(52(87)74-42(30-38(63(98)99)64(100)101)60(95)80-25-8-13-44(80)53(88)72-39(65(102)103)12-6-22-70-66(68)69)73-54(89)45-14-9-26-81(45)61(96)43(31-50(85)86)76-55(90)46-15-10-24-79(46)59(94)41(29-36-18-20-37(83)21-19-36)75-56(91)47-16-11-27-82(47)62(97)51(34(3)4)77-57(92)48-17-7-23-78(48)58(93)35(5)71-49(84)32-67/h18-21,33-35,38-48,51,83H,6-17,22-32,67H2,1-5H3,(H,71,84)(H,72,88)(H,73,89)(H,74,87)(H,75,91)(H,76,90)(H,77,92)(H,85,86)(H,98,99)(H,100,101)(H,102,103)(H4,68,69,70)/t35-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,51-/m0/s1

InChIKey=NXRQRIXBBRITHW-LCDSTIRBSA-N

CC(C)C[C@@H](C(=O)N[C@@H](CC(C(=O)O)C(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](Cc4ccc(cc4)O)NC(=O)[C@@H]5CCCN5C(=O)[C@H](C(C)C)NC(=O)[C@@H]6CCCN6C(=O)[C@H](C)NC(=O)CN

氢键供体数量:16

氢键受体数量:37

XLogP3:-9.0

Bulk/Fine:F