InChIKey | HGLXRQTVQUQBET-CKNDICEZSA-N |
Inchi | 1S/C50H57O4P.C15H15NO/c1-27(2)35-23-39(29(5)6)45(40(24-35)30(7)8)43-21-33-17-13-15-19-37(33)47-48-38-20-16-14-18-34(38)22-44(50(48)54-55(51,52)53-49(43)47)46-41(31(9)10)25-36(28(3)4)26-42(46)32(11)12;1-12(16-14-6-4-3-5-7-14)13-8-10-15(17-2)11-9-13/h13-32H,1-12H3,(H,51,52);3-11H,1-2H3/b;16-12-/i;16+1 |
SMILES | C(C1=C(C2C3OP(O)(=O)OC4C(C5C(=CC(C(C)C)=CC=5C(C)C)C(C)C)=CC5C(C=4C=3C3C(C=2)=CC=CC=3)=CC=CC=5)C(=CC(=C1)C(C)C)C(C)C)(C)C.C1=CC(OC)=CC=C1/C(/C)=[15N]\C1=CC=CC=C1 |