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Substance Name: Arachidoyl-coenzyme A
RN: 15895-27-9
InChIKey: JYLSVNBJLYCSSW-IBYUJNRCSA-N

Molecular Formula

  • C41-H74-N7-O17-P3-S

Molecular Weight

  • 1062.0556
 
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Names and Synonyms

Name of Substance

  • Arachidoyl-coenzyme A

Synonyms

  • Arachidoyl-coa
  • Coenzyme A, arachidoyl-

Systematic Name

  • Coenzyme A, S-eicosanoate

Registry Numbers

CAS Registry Number

  • 15895-27-9

System Generated Number

  • 0015895279

Structure Descriptors

InChI

1S/C41H74N7O17P3S/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/h28-30,34-36,40,51-52H,4-27H2,1-3H3,(H,43,49)(H,44,53)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56)/t30-,34-,35-,36+,40-/m1/s1

InChIKey

JYLSVNBJLYCSSW-IBYUJNRCSA-N

Smiles

CCCCCCCCCCCCCCCCCCCC(=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)n2cnc3c2ncnc3N)O)OP(=O)(O)O)O