恩波酸副品红

7232-51-1

MFCD09842140

C23 H18 O6 . C19 H17 N3

677.753

InChI=1S/C23H18O6.C19H17N3/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-3,5-7,9-10,24-25H,4,8,11H2,(H,26,27)(H,28,29);1-12,20H,21-22H2

InChIKey=XHLPMSLTEKLMTP-UHFFFAOYSA-N

c1ccc2c(c1)cc(c(c2Cc3c4c(cc(c3O)C(=O)O)C=CCC4)O)C(=O)O.c1cc(ccc1C(=C2C=CC(=N)C=C2)c3ccc(cc3)N)N

pro_donors:4

pro_acceptors:6

XLogP3:7.0

Bulk/Fine:F