CHEBI:62243 - trans,trans-octa-2,4-dienoyl-CoA(4−)

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ChEBI Name trans,trans-octa-2,4-dienoyl-CoA(4−) ChEBI ID CHEBI:62243 ChEBI ASCII Name trans,trans-octa-2,4-dienoyl-CoA(4-) Definition A trans,trans-2,3,4,5-tetradehydroacyl-CoA(4−) arising from deprotonation of the phosphate and diphosphate OH groups of trans,trans-octa-2,4-dienoyl-CoA; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C29H42N7O17P3S Net Charge -4 Average Mass 885.66700 Monoisotopic Mass 885.15927 InChI InChI=1S/C29H46N7O17P3S/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/h6-9,16-18,22-24,28,39-40H,4-5,10-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/p-4/b7-6+,9-8+/t18-,22-,23-,24+,28-/m1/s1 InChIKey HOQIPZYVEOMJGX-FPWOLYQWSA-J SMILES CCC\C=C\C=C\C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12 ChEBI Ontology Outgoing trans,trans-octa-2,4-dienoyl-CoA(4−) (CHEBI:62243) is a 6-saturated-trans,trans-2,4-dienoyl-CoA(4−) (CHEBI:85111) trans,trans-octa-2,4-dienoyl-CoA(4−) (CHEBI:62243) is a acyl-CoA(4−) (CHEBI:58342) trans,trans-octa-2,4-dienoyl-CoA(4−) (CHEBI:62243) is conjugate base of trans,trans-octa-2,4-dienoyl-CoA (CHEBI:62408) Incoming trans,trans-octa-2,4-dienoyl-CoA (CHEBI:62408) is conjugate acid of trans,trans-octa-2,4-dienoyl-CoA(4−) (CHEBI:62243) Synonyms Sources (2E,4E)-octa-2,4-dienoyl-CoA(4−) ChEBI (2E,4E)-octadienoyl-CoA UniProt (E,E)-octa-2,4-dienoyl-CoA(4−) ChEBI trans,trans-2,3,4,5-tetradehydroacyl-CoA (C8) (4−) SUBMITTER trans-Δ2,trans-Δ4-octadienoyl-CoA(4−) ChEBI Last Modified 05 March 2015