5'-dbb-tggg(mea)pa(mea)pg-3'

Structural Information

Molecular Formula

C₈₇H₁₀₆N₂₉O₃₆P₅

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COCC3=CC(=C(C=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OP(=O)(O)OCC6C(CC(O6)N7C=NC8=C7N=C(NC8=O)N)OP(=O)(O)OCC9C(CC(O9)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(NCCOC)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(NCCOC)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C87H106N29O36P5/c1-43-27-111(87(123)110-78(43)118)62-24-52(56(143-62)31-134-28-46-14-15-48(135-29-44-10-6-4-7-11-44)49(20-46)136-30-45-12-8-5-9-13-45)150-155(126,127)140-35-59-54(26-66(146-59)116-42-99-71-77(116)105-86(92)109-82(71)122)152-157(130,131)141-36-60-53(25-65(147-60)115-41-98-70-76(115)104-85(91)108-81(70)121)151-156(128,129)139-34-58-51(23-64(145-58)114-40-97-69-75(114)103-84(90)107-80(69)120)149-154(125,101-17-19-133-3)138-33-57-50(22-63(144-57)112-38-95-67-72(88)93-37-94-73(67)112)148-153(124,100-16-18-132-2)137-32-55-47(117)21-61(142-55)113-39-96-68-74(113)102-83(89)106-79(68)119/h4-15,20,27,37-42,47,50-66,117H,16-19,21-26,28-36H2,1-3H3,(H,100,124)(H,101,125)(H,126,127)(H,128,129)(H,130,131)(H2,88,93,94)(H,110,118,123)(H3,89,102,106,119)(H3,90,103,107,120)(H3,91,104,108,121)(H3,92,105,109,122)

InChIKey

BTIKERQZBVJQLP-UHFFFAOYSA-N

Compound name

[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-(2-methoxyethylamino)phosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-(2-methoxyethylamino)phosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methyl [2-[[3,4-bis(phenylmethoxy)phenyl]methoxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] hydrogen phosphate

Related CIDs

• CID 16197641