Details
lidin-2-one
InChIKey=RVPPUDUPOGVQTI-JADLMOLYSA-N
InChI=1S/C50H50N4O8/c1-25(2)39-33-19-27(5)41(47(59)43(33)35(45(57)49(39)61)23-51-29-11-7-13-31(21-29)53-17-9-15-37(53)55)42-28(6)20-34-40(26(3)4)50(62)46(58)36(44(34)48(42)60)24-52-30-12-8-14-32(22-30)54-18-10-16-38(54)56/h7-8,11-14,19-26,57-62H,9-10,15-18H2,1-6H3/b51-23+,52-24+
c1(c2c(cc(c(c2O)c2c(c3c(c(O)c(c(c3cc2C)C(C)C)O)/C=N\c2cc(ccc2)N2C(CCC2)=O)O)C)c(c(c1O)O)C(C)C)/C=N\c1cccc(c1)N1C(CCC1)=O
C50H50N4O8 |
834.97 |
10.59 |
-8.54 |
0 |
1 |
8 |
6 |
11 |
0 |
12 |