化学式

CAS号

IUPAC Name

[3-[6-氨基-9-[2-氧代-6-[1-[[(1-氧代-1-丙烷-2-yloxypropan-2-基)氨基]-phenoxyphosphoryl]oxyethyl]-3a,4,6,6a-四氢呋喃并[3,4-d][1,3]二氧杂环戊烯-4-基]嘌呤-2-基]-2,2-二甲基丙基]2-[[1-[5-(6-aminopurin-9-基)-3-(1-羟基丙氧基)-4-propanoyloxyoxolan-2-基]乙氧基-phenoxyphosphoryl]氨基]丙酸酯 [3-[6-amino-9-[2-oxo-6-[1-[[(1-oxo-1-propan-2-yloxypropan-2-yl)amino]-phenoxyphosphoryl]oxyethyl]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-2-yl]-2,2-dimethylpropyl] 2-[[1-[5-(6-aminopurin-9-yl)-3-(1-hydroxypropoxy)-4-propanoyloxyoxolan-2-yl]ethoxy-phenoxyphosphoryl]amino]propanoate

InChI

InChI=1S/C55H72N12O19P2/c1-11-36(68)77-42-40(79-50(44(42)78-37(69)12-2)66-26-60-38-46(56)58-25-59-48(38)66)31(7)83-87(73,85-33-19-15-13-16-20-33)64-29(5)52(70)75-24-55(9,10)23-35-62-47(57)39-49(63-35)67(27-61-39)51-45-43(81-54(72)82-45)41(80-51)32(8)84-88(74,86-34-21-17-14-18-22-34)65-30(6)53(71)76-28(3)4/h13-22,25-32,36,40-45,50-51,68H,11-12,23-24H2,1-10H3,(H,64,73)(H,65,74)(H2,56,58,59)(H2,57,62,63)

InChI Key

QALGOPQRFQACAH-UHFFFAOYSA-N

Canonical SMILES

CCC(O)OC1C(C(OC1C(C)OP(=O)(NC(C)C(=O)OCC(C)(C)CC2=NC(=C3C(=N2)N(C=N3)C4C5C(C(O4)C(C)OP(=O)(NC(C)C(=O)OC(C)C)OC6=CC=CC=C6)OC(=O)O5)N)OC7=CC=CC=C7)N8C=NC9=C(N=CN=C98)N)OC(=O)CC

别名