Molecular formula: | C26H42N7O17P3S |
Average mass: | 849.636 |
Monoisotopic mass: | 849.157074 |
ChemSpider ID: | 4947725 |
5 of 7 defined stereocentres
Double-bond stereo
(2E)-2-Méthyl-2-butènethioate 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-1 1,15-diaza-3λ~5~,5λ~5~-diphosphaheptadécan-17-yle}
[French]
[ACD/IUPAC Name]2-methylbut-2-enoyl-Coenzyme A
2-methylcrotonoyl-CoA
6247-62-7
[RN]Adenosine, 5′-O-[hydroxy[[hydroxy[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-[[2-[[(2E)-2-methyl-1-oxo-2-buten-1-yl]thio]ethyl]amino]-3-oxopropyl]amino]-4-oxobutoxy]phosphinyl]oxy]phosphinyl]-, 3′-(dihydrogen phosphate)
[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)-2-methyl-2-butenethioate
[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)-2-methyl-2-butenthioat
[German]
[ACD/IUPAC Name]Tiglyl-CoA
(E)-2-Methylcrotonoyl-CoA
2-methyl-2E-butenoyl-CoA
2-Methylcrotanoyl-CoA
3′-phosphoadenosine 5′-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2E)-2-methylbut-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}
Coenzyme A, S-(2-methyl-2-butenoate), (E)-
Coenzyme A, tiglyl-
Methylcrotonoyl-CoA
Methylcrotonyl-CoA
tigloyl-CoA
Tiglyl-coenzyme A
trans-2-Methylbut-2-enoyl-CoA