Details
phthalene-1
InChIKey=OGFVYQAIQXMJMJ-JLKIIGCMSA-N
InChI=1S/C48H52N2O12/c1-21(2)35-29-15-23(5)37(45(59)39(29)31(43(57)47(35)61)17-49-27-11-7-25(8-12-27)41(55)33(53)19-51)38-24(6)16-30-36(22(3)4)48(62)44(58)32(40(30)46(38)60)18-50-28-13-9-26(10-14-28)42(56)34(54)20-52/h7-18,21-22,33-34,41-42,51-62H,19-20H2,1-6H3/b49-17+,50-18+
c1(c(O)c(c2cc(C)c(c3c(c4c(cc3C)c(c(O)c(O)c4/C=N\c3ccc(cc3)C(C(O)CO)O)C(C)C)O)c(c2c1/C=N\c1ccc(cc1)C(O)C(CO)O)O)C(C)C)O
C48H52N2O12 |
848.95 |
7.37 |
-7.1 |
0 |
0 |
12 |
12 |
21 |
4 |
14 |