Chemical Compound

J835.703J

J835.703J chemical structure
Primary Record

J835.703J

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177442788
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)O[C@H]3C[C@@H](O[C@@H]3COP(=O)(O)O[C@@H]4[C@H](O[C@H]([C@@H]4NS(=O)(=O)C5=CC=CC6=C5C=CC=C6N(C)C)N7C=CC(=O)NC7=O)CO)N8C=CC(=NC8=O)N)OP(=O)(O)OC[C@@H]9[C@H](C[C@@H](O9)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)O
Canonical SMILES
Cc1cn([C@H]2C[C@H](OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(=O)[nH]c(N)nc54)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(=O)[nH]c(N)nc54)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(=O)[nH]c(N)nc54)C[C@@H]3O)[C@@H](COP(=O)(O)O[C@H]3C[C@H](n4ccc(N)nc4=O)O[C@@H]3COP(=O)(O)O[C@H]3[C@@H](NS(=O)(=O)c4cccc5c(N(C)C)cccc45)[C@H](n4ccc(=O)[nH]c4=O)O[C@@H]3CO)O2)c(=O)[nH]c1=O

Names & Synonyms

  • J835.703J
  • {[(2R,3S,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3-[({[(2R,3S,5R)-3-[({[(2R,3S,5R)-3-[({[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-3-[({[(2R,3S,5R)-3-[({[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-3-[({[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]-5-(6-amino-9H-purin-9-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]-5-(6-amino-9H-purin-9-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]oxolan-2-yl]methoxy}({[(2R,3S,4R,5R)-4-[5-(dimethylamino)naphthalene-1-sulfonamido]-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy})phosphinic acid
  • 5 -O-[5 -O-[5 -O-[5 -O-[5 -O-[5 -O-[5 -O-[2 -[5-(Dimethylamino)-1-naphthylsulfonylamino]-2 -deoxy-3 -uridylyl]-2 -deoxy-3 -cytidylyl]-3 -thymidylyl]-2 -deoxy-3 -adenylyl]-2 -deoxy-3 -guanylyl]-2 -deoxy-3 -adenylyl]-2 -deoxy-3 -guanylyl]-2 -deoxyguanosine