S-(2E)-2-Octenoate Coenzyme A Sodium Salt
Product Specifications
Synonyms
2,3-trans-Octenoyl coenzyme A; 2-Trans octenoyl-CoA; Oct-2-trans-enoyl-CoA Sodium Salt; Oct-trans-2-enoyl coenzyme A; trans-Δ2,3-Octenoyl-CoA Sodium Salt
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
NC1=NC=NC2=C1N=CN2[C@H]3[C@H](O)[C@H](OP(O)([O-])=O)[C@@H](COP(OP(O)(OCC([C@@H](C(NCCC(NCCSC(/C=C/CCCCC)=O)=O)=O)O)(C)C)=O)(O)=O)O3.[Na+]
Molecular Formula
C29H48N7O17P3S . xNa
InChI
InChI=1S/C29H48N7O17P3S.Na/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36;/h8-9,16-18,22-24,28,39-40H,4-7,10-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44);/q;+1/p-1/b9-8+;/t18-,22-,23-,24-,28-;/m1./s1
Additionnal Information
IUPAC name: sodium (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(((hydroxy((hydroxy((S)-3-hydroxy-2,2-dimethyl-4-((3-((2-(((E)-oct-2-enoyl)thio)ethyl)amino)-3-oxopropyl)amino)-4-oxobutoxy)phosphoryl)oxy)phosphoryl)oxy)methyl)tetrahydrofuran-3-yl hydrogen phosphate
Shipping Conditions
Room Temperature
Storage Conditions
-20°C
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