Chemical Compound

CHEMBL398256

CAS Registry Number 943962-24-1
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CHEMBL398256 chemical structure
Primary Record

CHEMBL398256

In stock
897 g
Purity
98.6 %
CAS
943962-24-1

Compound Identifiers & Properties

CAS
943962-24-1
PubChem CID
44441891
SMILES
CCCCCC(C(C(=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)F)O
Canonical SMILES
CCCCCC(O)C(F)C(=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

  • CHEMBL398256
  • orb3022207
  • 2-fluoro-3-hydroxyoctanoyl-CoA; (Acyl-CoA); [M+H]+;
  • 943962-24-1