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9-{(2ξ)-5-O-[{[{[(3R,4Z)-3,4-Dihydroxy-4-{[(3Z)-3-hydroxy-3-({2-[(11E)-11-octadecenoylsulfanyl]ethyl}imino)propyl]imino}-2,2-dimethylbutyl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phospho no-β-D-threo-pentofuranosyl}-9H-purin-6-amine

Molecular formula:C39H68N7O17P3S
Average mass:1031.987
Monoisotopic mass:1031.360525
ChemSpider ID:59651610
stereocenter-icon

4 of 7 defined stereocentres

double-bond-stereo-icon

Double-bond stereo

plus-iconless-iconStructural identifiers
  • Names down_Arrow
plus-iconless-iconNames and synonyms
Verified

(11E)-11-Octadécènethioate de S-{(9R)-1-[(2R,3R,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-d iaza-3λ~5~,5λ~5~-diphosphaheptadécan-17-yle} (non-preferred name)

[French]

[ACD/IUPAC Name]

9-{(2ξ)-5-O-[{[{[(3R,4Z)-3,4-Dihydroxy-4-{[(3Z)-3-hydroxy-3-({2-[(11E)-11-octadecenoylsulfanyl]ethyl}imino)propyl]imino}-2,2-dimethylbutyl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phospho no-β-D-threo-pentofuranosyl}-9H-purin-6-amin

[German]

[ACD/IUPAC Name]

9-{(2ξ)-5-O-[{[{[(3R,4Z)-3,4-Dihydroxy-4-{[(3Z)-3-hydroxy-3-({2-[(11E)-11-octadecenoylsulfanyl]ethyl}imino)propyl]imino}-2,2-dimethylbutyl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phospho no-β-D-threo-pentofuranosyl}-9H-purin-6-amine

[ACD/IUPAC Name]

9-{(2ξ)-5-O-[{[{[(3R,4Z)-3,4-Dihydroxy-4-{[(3Z)-3-hydroxy-3-({2-[(11E)-11-octadecenoylsulfanyl]éthyl}imino)propyl]imino}-2,2-diméthylbutyl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phospho no-β-D-thréo-pentofuranosyl}-9H-purin-6-amine

[French]

[ACD/IUPAC Name]

9H-Purin-6-amine, 9-[(2ξ)-5-O-[[[[[(3R,4Z)-3,4-dihydroxy-4-[[(3Z)-3-hydroxy-3-[[2-[[(11E)-1-oxo-11-octadecen-1-yl]thio]ethyl]imino]propyl]imino]-2,2-dimethylbutyl]oxy]hydroxyphosphinyl]oxy]hydroxypho sphinyl]-3-O-phosphono-β-D-threo-pentofuranosyl]-

[ACD/Index Name]

9H-Purin-6-amine, 9-[(2ξ)-5-O-[hydroxy[[hydroxy[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[[2-[[(11E)-1-oxo-11-octadecen-1-yl]thio]ethyl]amino]propyl]amino]butoxy]phosphinyl]oxy]phosphinyl]-3-O-p hosphono-β-D-threo-pentofuranosyl]-

[ACD/Index Name]

S-{(9R)-1-[(2R,3R,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~-dip hosphaheptadecan-17-yl} (11E)-11-octadecenethioate (non-preferred name)

[ACD/IUPAC Name]

S-{(9R)-1-[(2R,3R,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~-dip hosphaheptadecan-17-yl}-(11E)-11-octadecenthioat (non-preferred name)

[German]

[ACD/IUPAC Name]
Unverified

11-Octadecenoyl CoA

11-Octadecenoyl Coenzyme A

13673-88-6

[RN]

cis-vaccenoyl CoA

cis-vaccenoyl coenzyme A

cis-Vaccenoyl-coa

cis-Vaccenoyl-coenzyme

cis-Vaccenoyl-coenzyme A

R-11-Octadecenoate

R-11-Octadecenoate CoA

R-11-Octadecenoate Coenzyme A

R-11-Octadecenoic acid

R-11-Octadecenoyl CoA

R-11-Octadecenoyl Coenzyme A

Vaccenoyl CoA

Vaccenoyl Coenzyme A

Vaccenoyl-coa

Vaccenoyl-coenzyme

Vaccenoyl-coenzyme A

Vaccenyl coenzyme A

{[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-[(2-{[2-(octadec-11-enoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid