Molecule: (E)-hexadec-2-enoyl-CoA(4-)
A hexadecenoyl-CoA(4-) obtained by deprotonation of the phosphate and diphosphate OH groups of (E)-hexadec-2-enoyl-CoA; major species at pH 7.3.
Synonyms for (E)-hexadec-2-enoyl-CoA(4-) :
(2E)-hexadecenoyl-CoA
(E)-C16:1 n-14-CoA
(E)-hexadec-2-enoyl-CoA tetraanion
(E)-hexadec-2-enoyl-coenzyme A tetraanion
(E)-hexadec-2-enoyl-coenzyme A(4-)
trans-2-hexadecenoyl-CoA(4-)
trans-2-hexadecenoyl-coenzyme A tetraanion
trans-2-hexadecenoyl-coenzyme A(4-)
trans-C16:1 n-14-CoA
trans-hexadec-2-enoyl-CoA(4-)
Molecular Formula: C37H60N7O17P3S
Molecular wt: 999.898 g/mole
Charge: -4
SMILES: [C@@H]1(N2C3=C(C(=NC=N3)N)N=C2)O[C@H](COP(OP(OCC([C@H](C(NCCC(NCCSC(=O)/C=C/CCCCCCCCCCCCC)=O)=O)O)(C)C)(=O)[O-])(=O)[O-])[C@H]([C@H]1O)OP([O-])([O-])=O
InChIKey: JUPAQFRKPHPXLD-MSHHSVQMSA-J
InChI=1S/C37H64N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(46)65-21-20-39-27(45)18-19-40-35(49)32(48)37(2,3)23-58-64(55,56)61-63(53,54)57-22-26-31(60-62(50,51)52)30(47)36(59-26)44-25-43-29-33(38)41-24-42-34(29)44/h16-17,24-26,30-32,36,47-48H,4-15,18-23H2,1-3H3,(H,39,45)(H,40,49)(H,53,54)(H,55,56)(H2,38,41,42)(H2,50,51,52)/p-4/b17-16+/t26-,30-,31-,32+,36-/m1/s1
Sample reactions for this molecule: