Names and Identifiers

• • Coenzyme A,3'-O-dephosphono-, S-acetate (9CI)
  • Acetyl-dephospho-coenzyme A
  • Acetyl-dephospho-coa
  • Coenzyme A, 3'-O-dephosphono-, S-acetate
  • 9-{5-O-[{[{4-[(3-{[2-(Acetylsulfanyl)ethyl]imino}-3-hydroxypropyl)imino]-3,4-dihydroxy-2,2-dimethylbutoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]pentofuranosyl}-9H-purin-6-amine
  • Acetyldephospho-CoA
  • 3'-Dephosphoacetyl-CoA
  • Adenosine pyrophosphate, 5'→4-ester with 2,4-dihydroxy-N-[2-[(2-mercaptoethyl)carbamoyl]ethyl]-3,3- dimethylbutyramide, S-acetate (7CI)
  • Adenosine 5'-(trihydrogen pyrophosphate), 5'→4'-ester with 2,4-dihydroxy-N-[2-[(2-mercaptoethyl)carbamoyl]ethyl]-3,3- dimethylbutyramide S-acetate (8CI)
  • 31664-34-3
  • S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] ethanethioate
  • DTXSID40953627
  • Adenosine 5'-(trihydrogen pyrophosphate), 5'→4'-ester with 2,4-dihydroxy-N-[2-[(2-mercaptoethyl)carbamoyl]ethyl]-3,3-dimethylbutyramide S-acetate (8CI)
  • Adenosine pyrophosphate, 5'→4-ester with 2,4-dihydroxy-N-[2-[(2-mercaptoethyl)carbamoyl]ethyl]-3,3-dimethylbutyramide, S-acetate (7CI)
  • 3'-Dephosphoacetyl-CoA
  • Acetyldephospho-CoA
  • +expand
• • Inchi： 1S/C23H37N7O14P2S/c1-12(31)47-7-6-25-14(32)4-5-26-21(36)18(35)23(2,3)9-42-46(39,40)44-45(37,38)41-8-13-16(33)17(34)22(43-13)30-11-29-15-19(24)27-10-28-20(15)30/h10-11,13,16-18,22,33-35H,4-9H2,1-3H3,(H,25,32)(H,26,36)(H,37,38)(H,39,40)(H2,24,27,28)/t13-,16-,17-,18+,22-/m1/s1
  • InChI Key： XEFUABMMGJVHSD-ZSJPKINUSA-N
  • SMILES： S(C(C)=O)CCNC(CCNC([C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@H](N2C=NC3C(N)=NC=NC2=3)O1)O)O)O)=O)=O

Computed Properties

Experimental Properties