Dmtr-tgggagg-3'

Structural Information

Molecular Formula

C₉₁H₁₀₅N₃₂O₄₅P₇

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)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)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)O

InChI

InChI=1S/C91H105N32O45P7/c1-39-24-117(90(131)116-79(39)125)60-18-46(58(156-60)31-154-175(144,145)168-91(40-7-5-4-6-8-40,41-9-13-43(146-2)14-10-41)42-11-15-44(147-3)16-12-42)162-170(134,135)150-28-55-49(21-63(159-55)121-36-103-69-76(121)108-87(95)113-82(69)128)166-173(140,141)153-30-57-51(23-65(161-57)123-38-105-71-78(123)110-89(97)115-84(71)130)167-174(142,143)152-29-56-50(22-64(160-56)122-37-104-70-77(122)109-88(96)114-83(70)129)165-172(138,139)149-26-53-47(19-61(157-53)118-33-100-66-72(92)98-32-99-73(66)118)164-171(136,137)151-27-54-48(20-62(158-54)120-35-102-68-75(120)107-86(94)112-81(68)127)163-169(132,133)148-25-52-45(124)17-59(155-52)119-34-101-67-74(119)106-85(93)111-80(67)126/h4-16,24,32-38,45-65,124H,17-23,25-31H2,1-3H3,(H,132,133)(H,134,135)(H,136,137)(H,138,139)(H,140,141)(H,142,143)(H,144,145)(H2,92,98,99)(H,116,125,131)(H3,93,106,111,126)(H3,94,107,112,127)(H3,95,108,113,128)(H3,96,109,114,129)(H3,97,110,115,130)

InChIKey

AGXZGPOIRDZDOA-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-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-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 [bis(4-methoxyphenyl)-phenylmethyl] hydrogen phosphate

Related CIDs

• CID 16197655