Product Name:
(3E)-nonenoyl-CoA(4-)
Other Names: (3E)-nonenoyl-CoA(4-);trans-3-nonenoyl-CoA(4-);(E)-non-3-enoyl-CoA(4-);CHEBI:85655;(3E)-nonenoyl-coenzyme A(4-);trans-3-nonenoyl-coenzyme A(4-);(E)-non-3-enoyl-coenzyme A(4-);Q27158685
Other Names: (3E)-nonenoyl-CoA(4-);trans-3-nonenoyl-CoA(4-);(E)-non-3-enoyl-CoA(4-);CHEBI:85655;(3E)-nonenoyl-coenzyme A(4-);trans-3-nonenoyl-coenzyme A(4-);(E)-non-3-enoyl-coenzyme A(4-);Q27158685
Structural Information
Molecular Formula | C30H46N7O17P3S-4 | Molecular Weight | 901.7 | ||
IUPAC Name | [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-[2-[(E)-non-3-enoyl]sulfanylethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate | ||||
InChIKey | VCVDAYMNOMYZHZ-KZKUDURGSA-J | ||||
InChI | InChI=1S/C30H50N7O17P3S/c1-4-5-6-7-8-9-10-21(39)58-14-13-32-20(38)11-12-33-28(42)25(41)30(2,3)16-51-57(48,49)54-56(46,47)50-15-19-24(53-55(43,44)45)23(40)29(52-19)37-18-36-22-26(31)34-17-35-27(22)37/h8-9,17-19,23-25,29,40-41H,4-7,10-16H2,1-3H3,(H,32,38)(H,33,42)(H,46,47)(H,48,49)(H2,31,34,35)(H2,43,44,45)/p-4/b9-8+/t19-,23-,24-,25+,29-/m1/s1 | ||||
SMILES | CCCCCC=CCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)([O-])[O-])O |