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[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[3-[2-[2-[2-[2-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphinothioyl]oxy-oxolan-2-yl]methoxy-oxidanyl-phosphinothioyl]oxy-oxolan-2-yl]methoxy-sulfanyl-phosphoryl]oxy-oxolan-2-yl]methoxy-oxidanyl-pho

Systemtic Name:	[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[3-[2-[2-[2-[2-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphinothioyl]oxy-oxolan-2-yl]methoxy-oxidanyl-phosphinothioyl]oxy-oxolan-2-yl]methoxy-sulfanyl-phosphoryl]oxy-oxolan-2-yl]methoxy-oxidanyl-pho
Openeye Name:	[17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[3-[2-[2-[2-[2-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphinothioyl]oxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphinothioyl]oxy-tetrahydrofuran-2-yl]methoxy-sulfanyl-phosphoryl]oxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-3-
CAS Name:	N-[3-[2-[2-[2-[2-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]methoxy-hydroxyphosphinothioyl]oxy-2-oxolanyl]methoxy-hydroxyphosphinothioyl]oxy-2-oxolanyl]methoxy-mercaptophosphoryl]oxy-2-oxolanyl]methoxy-hydroxyphosphoryl]oxy-3-hydroxypropoxy]ethoxy]ethoxy]ethoxy]propyl]carbamic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phe
IUPAC Name:	[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[3-[2-[2-[2-[2-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-sulfanylphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxypropoxy]ethoxy]ethoxy]ethoxy]propyl
Traditional Name:	N-[3-[2-[2-[2-[2-[[5-(2-amino-6-keto-3H-purin-9-yl)-3-[[5-(2-amino-6-keto-3H-purin-9-yl)-3-[[5-(2-amino-6-keto-3H-purin-9-yl)-3-[[5-(2-amino-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-thiophosphoryl]oxy-tetrahydrofuran-2-yl]methoxy-hydroxy-thiophosphoryl]oxy-tetrahydrofuran-2-yl]methoxy-mercapto-phosphoryl]oxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-3-hydroxy-propoxy]ethoxy]ethoxy]ethoxy]propyl]carbamic acid [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,1
Formula:	C₈₀H₁₂₁N₂₁O₂₉P₄S₃
MolecularWeight:	2061.030084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)NCCCOCCOCCOCCOCC(CO)OP(=O)(O)OCC5C(CC(O5)N6C=NC7=C6NC(=NC7=O)N)OP(=O)(OCC8C(CC(O8)N9C=NC1=C9NC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1NC(=NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1NC(=NC2=O)N)O)S)C)C

Isomeric SMILES

InChI

InChI=1S/C80H121N21O29P4S3/c1-41(2)8-6-9-42(3)47-12-13-48-46-11-10-43-26-44(14-16-79(43,4)49(46)15-17-80(47,48)5)122-78(108)85-18-7-19-114-20-21-115-22-23-116-24-25-117-32-45(31-102)127-131(109,110)118-34-55-51(28-59(124-55)99-38-87-63-67(99)91-75(82)95-71(63)105)128-133(112,136)120-36-57-53(30-61(126-57)101-40-89-65-69(101)93-77(84)97-73(65)107)130-134(113,137)121-35-56-52(29-60(125-56)100-39-88-64-68(100)92-76(83)96-72(64)106)129-132(111,135)119-33-54-50(103)27-58(123-54)98-37-86-62-66(98)90-74(81)94-70(62)104/h37-61,102-103H,6-36H2,1-5H3,(H,85,108)(H,109,110)(H,111,135)(H,112,136)(H,113,137)(H3,81,90,94,104)(H3,82,91,95,105)(H3,83,92,96,106)(H3,84,93,97,107)

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