5'-dbb-d[tggga]-3'

Structural Information

Molecular Formula

C₇₁H₈₀N₂₂O₃₀P₄

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)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)O

InChI

InChI=1S/C71H80N22O30P4/c1-34-20-89(71(99)88-64(34)95)51-16-41(46(116-51)24-108-21-37-12-13-39(109-22-35-8-4-2-5-9-35)40(14-37)110-23-36-10-6-3-7-11-36)120-125(102,103)112-26-48-43(18-53(118-48)92-32-80-57-62(92)83-69(74)86-66(57)97)122-127(106,107)114-28-49-44(19-54(119-49)93-33-81-58-63(93)84-70(75)87-67(58)98)123-126(104,105)113-27-47-42(17-52(117-47)91-31-79-56-61(91)82-68(73)85-65(56)96)121-124(100,101)111-25-45-38(94)15-50(115-45)90-30-78-55-59(72)76-29-77-60(55)90/h2-14,20,29-33,38,41-54,94H,15-19,21-28H2,1H3,(H,100,101)(H,102,103)(H,104,105)(H,106,107)(H2,72,76,77)(H,88,95,99)(H3,73,82,85,96)(H3,74,83,86,97)(H3,75,84,87,98)

InChIKey

WJSGVHOLIXAJOW-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-[[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]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 16186586