2-trans-nonenoyl-CoA

Chemical Formula:

C₃₀H₄₆N₇O₁₇P₃S

Molecular Weight:

901.711 Daltons

Monoisotopic Mass:

905.2196734370999 Daltons

SMILES:

CCCCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]

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/h9-10,17-19,23-25,29,40-41H,4-8,11-16H2,1-3H3,(H,32,38)(H,33,42)(H,46,47)(H,48,49)(H2,31,34,35)(H2,43,44,45)/p-4/b10-9+/t19-,23-,24-,25+,29-/m1/s1

InChIKey:

HBLOTZDYPZAZLE-OWQWVSLFSA-J

Synonyms

2E-nonenoyl-CoA

Databases

MetaCyc: CPD-15663

PubChem (CID): 72193739

ChEBI: 76292

MetaNetX: MNXM145877