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Molecular Formula: C116H96N8O4
Molecular weight: 1666.05464
InChi: InChI=1S/C116H96N8O4/c1-9-57-127-115-79-13-11-14-80(115)60-86-64-84(112-103-55-51-99(123-103)109(77-37-25-71(7)26-38-77)95-47-43-91(119-95)106(74-31-19-68(4)20-32-74)92-44-48-96(120-92)110(100-52-56-104(112)124-100)78-39-27-72(8)28-40-78)66-88(114(86)126)62-82-16-12-15-81(116(82)128-58-10-2)61-87-65-83(63-85(59-79)113(87)125)111-101-53-49-97(121-101)107(75-33-21-69(5)22-34-75)93-45-41-89(117-93)105(73-29-17-67(3)18-30-73)90-42-46-94(118-90)108(98-50-54-102(111)122-98)76-35-23-70(6)24-36-76/h11-56,63-66,117,119,122,124-126H,9-10,57-62H2,1-8H3/b105-89-,105-90-,106-91-,106-92-,107-93-,107-97-,108-94-,108-98-,109-95-,109-99-,110-96-,110-100-,111-101-,111-102-,112-103-,112-104-
InChi Key: SUXOGBNTPDXBTH-BAZLUVNESA-N
SMILES: C\1(=C/2\N=C(C=C2)/C(=c/2\[nH]/c(=C(\C3=N/C(=C(\c4[nH]c1cc4)/c1ccc(cc1)C)/C=C3)/c1ccc(cc1)C)/cc2)/c1ccc(cc1)C)/c1cc2c(c(c1)Cc1c(c(Cc3c(c(Cc4c(c(C2)ccc4)OCCC)cc(c3)/C/2=C\3/N=C(C=C3)/C(=c/3\[nH]/c(=C(\C4=N/C(=C(\c5[nH]c2cc5)/c2ccc(cc2)C)/C=C4)/c2ccc(cc2)C)/cc3)/c2ccc(cc2)C)O)ccc1)OCCC)O
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