Molecular Formula: C₁₁₄H₁₁₂N₆O₈

Molecular weight: 1694.14448

InChi: InChI=1S/C114H112N6O8/c1-9-51-121-107-77-23-17-24-78(107)60-82-28-20-32-86(110(82)124-54-12-4)64-92-68-89(67-91(113(92)127-57-15-7)63-85-31-19-27-81(59-77)109(85)123-53-11-3)105-99-47-43-95(117-99)103(75-39-35-73(71-115)36-40-75)97-45-49-101(119-97)106(102-50-46-98(120-102)104(96-44-48-100(105)118-96)76-41-37-74(72-116)38-42-76)90-69-93-65-87-33-21-29-83(111(87)125-55-13-5)61-79-25-18-26-80(108(79)122-52-10-2)62-84-30-22-34-88(112(84)126-56-14-6)66-94(70-90)114(93)128-58-16-8/h17-50,67-70,117,120H,9-16,51-66H2,1-8H3/b103-95-,103-97-,104-96-,104-98-,105-99-,105-100-,106-101-,106-102-

InChi Key: CGPWROPORWYZAH-WDHJPXOYSA-N

SMILES: C\1(=c/2\[nH]/c(=C(\C3=N/C(=C(\c4[nH]c(/C(=C/5\N=C1C=C5)/c1ccc(cc1)C#N)cc4)/c1cc4c(c(c1)Cc1c(c(Cc5c(c(Cc6c(c(C4)ccc6)OCCC)ccc5)OCCC)ccc1)OCCC)OCCC)/C=C3)/c1ccc(cc1)C#N)/cc2)/c1cc2c(c(c1)Cc1c(c(Cc3c(c(Cc4c(c(C2)ccc4)OCCC)ccc3)OCCC)ccc1)OCCC)OCCC

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