Molecular formula: | C29H46N7O17P3S |
Average mass: | 889.701 |
Monoisotopic mass: | 889.188374 |
ChemSpider ID: | 58163534 |
5 of 7 defined stereocentres
Double-bond stereo
(2E,5Z)-2,5-Octadiènethioate de S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tétrahydro-2-furanyl]-3,5,9-trihydroxy-8,8-diméthyl-10,14-dioxo-3,5-dioxydo-2,4,6-trioxa-11 ,15-diaza-3λ~5~,5λ~5~-diphosphaheptadécan-17-yle} (non-preferred name)
[French]
[ACD/IUPAC Name](2E,5Z)-octadienoyl-CoA
Adenosine, 5′-O-[hydroxy[[hydroxy[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[[2-[[(2E,5Z)-1-oxo-2,5-octadien-1-yl]thio]ethyl]amino]propyl]amino]butoxy]phosphinyl]oxy]phosphinyl]-, 3′-(dihydrogen p hosphate)
[ACD/Index Name]S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydro-2-furanyl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3λ~5~,5λ~5~- diphosphaheptadecan-17-yl} (2E,5Z)-2,5-octadienethioate (non-preferred name)
[ACD/IUPAC Name]S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydro-2-furanyl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3λ~5~,5λ~5~- diphosphaheptadecan-17-yl}-(2E,5Z)-2,5-octadienthioat (non-preferred name)
[German]
[ACD/IUPAC Name](2E,5Z)-octadienoyl-coenzyme A
2E,5Z-octadienoyl-CoA
3′-phosphoadenosine 5′-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-[(2-{[(2E,5Z)-octa-2,5-dienoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)butyl] dihydrogen diphosphate}