Arachidonoyl CoA

CAS Registry Number®

17046-56-9

CAS Name

Arachidonoyl CoA

Molecular Formula

C41H66N7O17P3S

Molecular Mass

1053.99

Cite this Page

Arachidonoyl CoA.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17046-56-9 (retrieved 2024-11-21) (CAS RN: 17046-56-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C41H66N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(50)69-25-24-43-31(49)22-23-44-39(53)36(52)41(2,3)27-62-68(59,60)65-67(57,58)61-26-30-35(64-66(54,55)56)34(51)40(63-30)48-29-47-33-37(42)45-28-46-38(33)48/h8-9,11-12,14-15,17-18,28-30,34-36,40,51-52H,4-7,10,13,16,19-27H2,1-3H3,(H,43,49)(H,44,53)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56)/b9-8-,12-11-,15-14-,18-17-/t30-,34-,35-,36+,40-/m1/s1

InChIKey

InChIKey=JDEPVTUUCBFJIW-YQVDHACTSA-N

SMILES

O[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=CN3)O[C@H](COP(OP(OCC([C@H](C(NCCC(NCCSC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)=O)=O)O)(C)C)(=O)O)(=O)O)[C@H]1OP(=O)(O)O

Canonical SMILES

O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(N2C=NC=3C(=NC=NC32)N)C(O)C1OP(=O)(O)O)CCCC=CCC=CCC=CCC=CCCCCC

Other Names for this Substance

  • Coenzyme A, S-(5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoate
  • Coenzyme A, S-arachidonate
  • Coenzyme A, S-5,8,11,14-eicosatetraenoate, (all-Z)-
  • Arachidonoyl coenzyme A
  • Arachidonyl coenzyme A

View All

Deleted or Replaced CAS Registry Numbers

15477-53-9, 17046-63-8, 807320-72-5, 2092930-47-5

CAS INSIGHTSTM
Targeted protein degrader structure, illustration