1-[(2R,4S,5R)-5-[[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl]oxy-[5-[(6-chloranyl-2-methoxy-acridin-9-yl)amino]pentylamino]phosphoryl]oxymethyl]-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,4S,5R)-5-[[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl]oxy-[5-[(6-chloranyl-2-methoxy-acridin-9-yl)amino]pentylamino]phosphoryl]oxymethyl]-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,4S,5R)-5-[[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl]oxy-[5-[(6-chloro-2-methoxy-acridin-9-yl)amino]pentylamino]phosphoryl]oxymethyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,4S,5R)-5-[[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3-oxolanyl]oxy-[5-[(6-chloro-2-methoxy-9-acridinyl)amino]pentylamino]phosphoryl]oxymethyl]-4-hydroxy-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,4S,5R)-5-[[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-[5-[(6-chloro-2-methoxyacridin-9-yl)amino]pentylamino]phosphoryl]oxymethyl]-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(2R,4S,5R)-5-[[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-3-yl]oxy-[5-[(6-chloro-2-methoxy-acridin-9-yl)amino]pentylamino]phosphoryl]oxymethyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C60H65ClN7O14P MolecularWeight: 1174.623361

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(NCCCCCNC3=C4C=C(C=CC4=NC5=C3C=CC(=C5)Cl)OC)OC6CC(OC6COC(C7=CC=CC=C7)(C8=CC=C(C=C8)OC)C9=CC=C(C=C9)OC)N1C=C(C(=O)NC1=O)C)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO[P@@](=O)(NCCCCCNC3=C4C=C(C=CC4=NC5=C3C=CC(=C5)Cl)OC)O[C@H]6C[C@@H](O[C@@H]6COC(C7=CC=CC=C7)(C8=CC=C(C=C8)OC)C9=CC=C(C=C9)OC)N1C=C(C(=O)NC1=O)C)O

InChI

InChI=1S/C60H65ClN7O14P/c1-36-32-67(58(72)65-56(36)70)53-30-49(69)51(80-53)35-79-83(74,63-27-11-7-10-26-62-55-45-24-18-41(61)28-48(45)64-47-25-23-44(77-5)29-46(47)55)82-50-31-54(68-33-37(2)57(71)66-59(68)73)81-52(50)34-78-60(38-12-8-6-9-13-38,39-14-19-42(75-3)20-15-39)40-16-21-43(76-4)22-17-40/h6,8-9,12-25,28-29,32-33,49-54,69H,7,10-11,26-27,30-31,34-35H2,1-5H3,(H,62,64)(H,63,74)(H,65,70,72)(H,66,71,73)/t49-,50-,51+,52+,53+,54+,83-/m0/s1