BBM-928 C

76110-01-5

MFCD01939354

C60 H74 N14 O22

1343.32

InChI=1S/C60H74N14O22/c1-59(2,91)49-57(89)95-27-35(67-51(83)45-39(77)21-29-19-31(93-9)11-13-33(29)65-45)55(87)73-47(37(75)15-17-63-73)53(85)62-24-42(80)70(6)26-44(82)72(8)50(60(3,4)92)58(90)96-28-36(68-52(84)46-40(78)22-30-20-32(94-10)12-14-34(30)66-46)56(88)74-48(38(76)16-18-64-74)54(86)61-23-41(79)69(5)25-43(81)71(49)7/h11-14,17-22,35-38,47-50,75-78,91-92H,15-16,23-28H2,1-10H3,(H,61,86)(H,62,85)(H,67,83)(H,68,84)

InChIKey=KEKNHSVGJZJNFK-UHFFFAOYSA-N

CC(C)(C1C(=O)OCC(C(=O)N2C(C(CC=N2)O)C(=O)NCC(=O)N(CC(=O)N(C(C(=O)OCC(C(=O)N3C(C(CC=N3)O)C(=O)NCC(=O)N(CC(=O)N1C)C)NC(=O)c4c(cc5cc(ccc5n4)OC)O)C(C)(C)O)C)C)NC(=O)c6c(cc7cc(ccc7n6)OC)O)O

H bond donor:10

H bond acceptor:36

XLogP3:-4.0

Bulk/Fine:F