[3-[[5-(2-amino-6-oxo-1h-purin-9-yl)-3-[[5-(2-amino-6-oxo-1h-purin-9-yl)-3-[[5-(2-amino-6-oxo-1h-purin-9-yl)-3-[[3-[[5-(2-amino-6-oxo-1h-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl] hydrogen phosphate

Structural Information

Molecular Formula

C₈₇H₁₁₉N₂₇O₃₇P₆

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OC3CCC4(C5CCC6(C(C5CC=C4C3)CCC6C(C)CCCC(C)C)C)C)OP(=O)(O)OCC7C(CC(O7)N8C=NC9=C8N=C(NC9=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C87H119N27O37P6/c1-38(2)8-7-9-39(3)44-12-13-45-43-11-10-41-18-42(14-16-86(41,5)46(43)15-17-87(44,45)6)146-152(122,123)135-27-54-48(20-60(141-54)109-25-40(4)76(116)108-85(109)121)147-154(126,127)137-29-56-50(22-62(143-56)112-35-97-67-73(112)101-82(90)105-78(67)118)150-156(130,131)139-31-58-52(24-64(145-58)114-37-99-69-75(114)103-84(92)107-80(69)120)151-157(132,133)138-30-57-51(23-63(144-57)113-36-98-68-74(113)102-83(91)106-79(68)119)149-155(128,129)136-28-55-49(21-61(142-55)110-33-95-65-70(88)93-32-94-71(65)110)148-153(124,125)134-26-53-47(115)19-59(140-53)111-34-96-66-72(111)100-81(89)104-77(66)117/h10,25,32-39,42-64,115H,7-9,11-24,26-31H2,1-6H3,(H,122,123)(H,124,125)(H,126,127)(H,128,129)(H,130,131)(H,132,133)(H2,88,93,94)(H,108,116,121)(H3,89,100,104,117)(H3,90,101,105,118)(H3,91,102,106,119)(H3,92,103,107,120)

InChIKey

WEPXOPKIZSKAGH-UHFFFAOYSA-N

Compound name

[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen phosphate

Related CIDs

• CID 16131450