Molecular formula: | C28H42N7O19P3S |
Average mass: | 905.656 |
Monoisotopic mass: | 905.146903 |
ChemSpider ID: | 21865642 |
5 of 9 defined stereocentres
2,3-dihydroxy-2,3-dihydrobenzoyl-CoA
5,6-Dihydroxy-1,3-cyclohexadiène-1-carbothioate 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-diox ydo-2,4,6-trioxa-11,15-diaza-3λ~5~,5λ~5~-diphosphaheptadécan-17-yle}
[French]
[ACD/IUPAC Name]Adenosine, 5′-O-[[[[(3R)-4-[[3-[[2-[[(5,6-dihydroxy-1,3-cyclohexadien-1-yl)carbonyl]thio]ethyl]amino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]-, 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} 5,6-dihydroxy-1,3-cyclohexadiene-1-carbothioate
[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}-5,6-dihydroxy-1,3-cyclohexadien-1-carbothioat
[German]
[ACD/IUPAC Name]2,3-dihydro-2,3-dihydroxybenzoyl-CoA
2,3-dihydro-2,3-dihydroxybenzoyl-coenzyme A
3′-phosphoadenosine 5′-{3-[(3R)-4-({3-[(2-{[(5,6-dihydroxycyclohexa-1,3-dien-1-yl)carbonyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
adenosine, 5′-O-[[[[[(3R)-4-[[3-[[2-[[(5,6-dihydroxy-1,3-cyclohexadien-1-yl)carbonyl]thio]ethyl]amino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl]oxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]-, 3′-(dihydrogen phosphate)
S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-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} 5,6-dihydroxycyclohexa-1,3-diene-1-carbothioate (non-preferred name)