Chemical Compound

Cyclopropanecarboxyl-coa

CAS Registry Number 52530-01-5
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Cyclopropanecarboxyl-coa chemical structure
Primary Record

Cyclopropanecarboxyl-coa

In stock
6,407 g
Purity
98.8 %
CAS
52530-01-5

Compound Identifiers & Properties

CAS
52530-01-5
PubChem CID
9543331
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)C4CC4)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)C1CC1

Names & Synonyms

  • Cyclopropanecarboxyl-coa
  • S-Cyclopropanecarboxyl-coenzyme A
  • Coenzyme A, cyclopropanecarboxyl-
  • RefChem:919433
  • Coenzyme A, S-cyclopropanecarboxylate
  • CID9543331
  • C25-H40-N7-O17-P3-S
  • 52530-01-5
  • C16268
  • Cyclopropanecarboxyl-CoA; (Acyl-CoA); [M+H]+;
  • 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] cyclopropanecarbothioate