TDF杂质N(1962114-92-6)名称与标识符
名称
中文别名:
TDF杂质N;替诺福韦酯二聚体杂质1;替诺福韦单POC二聚体;富马酸替诺福韦二异丙酯IP杂质F;替诺福韦酯富马酸二甲吡酯IP杂质F;
英文别名:
Tenofovir Disoproxil Fumarate impurity N;Tenofovir impurity 6/Tenofovir Mono POC Dimer/2,4,7-Trioxa-5-phosphanonanoic acid, 5-hydroxy-9-[6-[[[[9-[(2R)-5-hydroxy-2,11-dimethyl-5-oxido-9-oxo-3,6,8,10-tetraoxa-5-phosphadodec-1-yl]-9H-purin-6-yl]amino]methyl]amino]-9H-purin-9-yl]-8-methyl-, 1-(1-met;2,4,7-Trioxa-5-phosphanonanoic acid, 5-hydroxy-9-[6-[[[[9-[(2R)-5-hydroxy-2,11-dimethyl-5-oxido-9-oxo-3,6,8,10-tetraoxa-5-phosphadodec-1-yl]-9H-purin-6-yl]amino]methyl]amino]-9H-purin-9-yl]-8-methyl-, 1-(1-methylethyl) ester, 5-oxide, (8R)-;
标识符
InChIKey:
HONHJROATOKUHX-NHCUHLMSSA-N
Inchi:
1S/C29H44N10O14P2/c1-18(2)52-28(40)46-14-50-54(42,43)16-48-20(5)7-38-12-36-22-24(32-10-34-26(22)38)30-9-31-25-23-27(35-11-33-25)39(13-37-23)8-21(6)49-17-55(44,45)51-15-47-29(41)53-19(3)4/h10-13,18-21H,7-9,14-17H2,1-6H3,(H,42,43)(H,44,45)(H,30,32,34)(H,31,33,35)/t20-,21-/m1/s1
SMILES:
C(OC(C)C)(=O)OCOP(=O)(O)CO[C@H](C)CN1C2C(N=C1)=C(NCNC1=C3C(=NC=N1)N(C[C@@H](C)OCP(=O)(O)OCOC(=O)OC(C)C)C=N3)N=CN=2