Chemical Compound

2,4-Dichlorobenzoyl-CoA

CAS Registry Number 150693-18-8
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2,4-Dichlorobenzoyl-CoA chemical structure
Primary Record

2,4-Dichlorobenzoyl-CoA

In stock
9,239 g
Purity
98.5 %
CAS
150693-18-8

Compound Identifiers & Properties

CAS
150693-18-8
PubChem CID
9543105
SMILES
CC(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)[C@H](C(=O)NCCC(=O)NCCSC(=O)C4=C(C=C(C=C4)Cl)Cl)O
Canonical SMILES
CC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)c1ccc(Cl)cc1Cl

Names & Synonyms

  • 2,4-Dichlorobenzoyl-CoA
  • 2,4-dichlorobenzoyl-coenzyme A
  • orb3022262
  • SCHEMBL2929838
  • SCHEMBL29741368
  • CHEBI:15470
  • c0189
  • CID9543105
  • C06671
  • 2,4-Dichlorobenzoyl-CoA; (Acyl-CoA); [M+H]+;
  • Q27089454
  • 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(2,4-dichlorobenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
  • S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2,4-dichlorobenzenecarbothioate
  • 150693-18-8