Chemical Compound

(2S)-2-(2-{[({[(2S,3S,5R)-2-[({[(2S,3S,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-[({[(2S,3S,5R)-2-[({[(2S,3S,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-[({[(2S,3S,5R)-2-[({[(2R,3S,5R)-2-({2-[(2S)-2-amino-3-phenylpropanamido]acetamido}methyl)-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-3-yl]oxy}(hydroxy)phosphoryl)(hydroxy)methyl]-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)phosphoryl)(hydroxy)methyl]oxolan-3-yl]oxy}(hydroxy)phosphoryl)(hydroxy)methyl]-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)phosphoryl)(hydroxy)methyl]oxolan-3-yl]oxy}(hydroxy)phosphoryl)(hydroxy)methyl]-5-(6-amino-9H-purin-9-yl)oxolan-3-yl]oxy}(hydroxy)phosphoryl)oxy]methyl}-2-methylpropanamido)-3-phenylpropanoic acid

Primary record

化合物标识与属性

PubChem CID: 177569923
SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CNC(=O)CNC(=O)[C@H](CC3=CC=CC=C3)N)OP(=O)(C([C@@H]4[C@H](C[C@@H](O4)N5C=NC6=C5N=C(NC6=O)N)OP(=O)(C([C@@H]7[C@H](C[C@@H](O7)N8C=CC(=NC8=O)N)OP(=O)(C([C@@H]9[C@H](C[C@@H](O9)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(C([C@@H]1[C@H](C[C@@H](O1)N1C=CC(=NC1=O)N)OP(=O)(C([C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC(C)(C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)O)O)O)O)O)O)O)O)O)O
Canonical SMILES: Cc1cn([C@H]2C[C@H](OP(=O)(O)C(O)[C@H]3O[C@@H](n4cnc5c(=O)[nH]c(N)nc54)C[C@@H]3OP(=O)(O)C(O)[C@H]3O[C@@H](n4ccc(N)nc4=O)C[C@@H]3OP(=O)(O)C(O)[C@H]3O[C@@H](n4cnc5c(=O)[nH]c(N)nc54)C[C@@H]3OP(=O)(O)C(O)[C@H]3O[C@@H](n4ccc(N)nc4=O)C[C@@H]3OP(=O)(O)C(O)[C@H]3O[C@@H](n4cnc5c(N)ncnc54)C[C@@H]3OP(=O)(O)OCC(C)(C)C(=O)N[C@@H](Cc3ccccc3)C(=O)O)[C@@H](CNC(=O)CNC(=O)[C@@H](N)Cc3ccccc3)O2)c(=O)[nH]c1=O