Gcgccca

Structural Information

Molecular Formula

C₆₆H₈₆N₂₇O₄₂P₇

SMILES

C1C(C(OC1N2C=NC3=C(N=CN=C32)N)COP(=O)(O)OC4CC(OC4COP(=O)(O)OC5CC(OC5COP(=O)(O)OC6CC(OC6COP(=O)(O)OC7CC(OC7COP(=O)(O)OC8CC(OC8COP(=O)(O)OC9CC(OC9COP(=O)(O)O)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C66H86N27O42P7/c67-41-1-5-87(63(97)79-41)46-10-28(130-137(104,105)117-16-34-27(94)9-45(123-34)91-24-76-52-55(71)74-23-75-56(52)91)36(124-46)18-118-138(106,107)131-29-11-47(88-6-2-42(68)80-64(88)98)125-37(29)19-119-139(108,109)132-30-12-48(89-7-3-43(69)81-65(89)99)127-39(30)21-121-142(114,115)135-33-15-51(93-26-78-54-58(93)84-62(73)86-60(54)96)129-40(33)22-122-140(110,111)133-31-13-49(90-8-4-44(70)82-66(90)100)126-38(31)20-120-141(112,113)134-32-14-50(128-35(32)17-116-136(101,102)103)92-25-77-53-57(92)83-61(72)85-59(53)95/h1-8,23-40,45-51,94H,9-22H2,(H,104,105)(H,106,107)(H,108,109)(H,110,111)(H,112,113)(H,114,115)(H2,67,79,97)(H2,68,80,98)(H2,69,81,99)(H2,70,82,100)(H2,71,74,75)(H2,101,102,103)(H3,72,83,85,95)(H3,73,84,86,96)

InChIKey

JXPMSTYAXSQHHA-UHFFFAOYSA-N

Compound name

[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-(phosphonooxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [5-(4-amino-2-oxopyrimidin-1-yl)-3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-[[5-(4-amino-2-oxopyrimidin-1-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 hydrogen phosphate

Related CIDs

• CID 16130339