Chemical Compound

J757.329D

J757.329D chemical structure
Primary Record

J757.329D

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
101994907
SMILES
CCCC(=O)O[C@H](C)CC(=O)O[C@H](C)CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
Canonical SMILES
CCCC(=O)O[C@H](C)CC(=O)O[C@H](C)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O

Names & Synonyms

  • J757.329D
  • S-[(3R,7R)-3,7-Dimethyl-1,5,9-trioxo-4,8-dioxadodecan-1-yl]coenzyme A
  • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-({2-[(2-{[(3R)-3-{[(3R)-3-(butanoyloxy)butanoyl]oxy}butanoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
  • Adenosine 3 -phosphoric acid 5 -[diphosphoric acid beta-[(R)-3-hydroxy-2,2-dimethyl-4-[[3-[[2-[[(3R,7R)-3,7-dimethyl-1,5,9-trioxo-4,8-dioxadodecane-1-yl]thio]ethyl]amino]-3-oxopropyl]amino]-4-oxobutyl]] ester
  • Adenosine 3 -phosphoric acid 5 -[diphosphoric acid P2-[(R)-3-hydroxy-2,2-dimethyl-3-[[2-[[2-[[(R)-3-[[(R)-3-(butyryloxy)butyryl]oxy]butyryl]thio]ethyl]carbamoyl]ethyl]carbamoyl]propyl]] ester