Chemical Compound

S-{(3r,5r,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-3lambda~5~,5lambda~5~-Diphosphaheptadecan-17-Yl} (9z)-Octadec-9-Enethioate (Non-Preferred Name)

CAS Registry Number 1716-06-9
S-{(3r,5r,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-3lambda~5~,5lambda~5~-Diphosphaheptadecan-17-Yl} (9z)-Octadec-9-Enethioate (Non-Preferred Name) 结构式
Primary record

S-{(3r,5r,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-3lambda~5~,5lambda~5~-Diphosphaheptadecan-17-Yl} (9z)-Octadec-9-Enethioate (Non-Preferred Name)

库存
9,349 克
纯度
99.6 %
CAS
1716-06-9

化合物标识与属性

CAS
1716-06-9
PubChem CID
5497111
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
Canonical SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O

名称与同义词

  • oleoyl-CoA
  • Oleoyl coenzyme A
  • Oleoyl-coenzyme A
  • S-Oleoylcoenzyme A
  • S-oleoyl-CoA
  • cis-9-Octadecenoyl-CoA
  • Oleyl coenzyme A
  • Oleyl-CoA
  • coenzyme A, oleoyl-
  • oleyl-coenzyme A
  • Oleoyl CoA
  • 9-Octadecenoyl-CoA
  • Coenzyme A oleate
  • (9Z)-Octadecenoyl-CoA
  • 9Z-octadecenoyl-CoA
  • [14C]oleoyl-CoA
  • (9Z)-octadec-9-enoyl-CoA
  • 9H-purin-6-amine,
  • cis-9-octadecenoyl-coenzyme A
  • [14C]Oleyl-CoA
  • AC1NUZHX
  • Coenzyme A, S-oleate
  • 9-Octadecenoyl-coenzyme A
  • cis-Delta(9)-octadecenoyl-CoA
  • 1716-06-9
  • cis-9-Octadecenoyl coenzyme A
  • RefChem:168099
  • o-beta-D-ribofuranosyl]-
  • (9Z)-octadec-9-enoyl-coenzyme A
  • D05HXE
  • [14C] oleoyl coenzyme A
  • Coenzyme A cis-9-octadecenoate
  • SPV646A327
  • cis-Delta(9)-octadecenoyl-coenzyme A
  • S-[(9Z)-octadec-9-enoyl]-CoA
  • CHEBI:15534
  • Oleoyl coenzyme A potassium salt
  • UNII-SPV646A327
  • C39H68N7O17P3S
  • XDUHQPOXLUAVEE-BPMMELMSSA-N
  • DTXSID601318533
  • GTPL2386
  • orb2944101
  • SCHEMBL29357246
  • BDBM27948
  • EINECS 216-998-8
  • S-[(9Z)-octadec-9-enoyl]-coenzyme A
  • DTXCID501748341
  • Octadecenoyl-CoA (n-C18:1CoA)
  • Coenzyme A, S-(9Z)-9-octadecenoate
  • S-((9Z)-octadec-9-enoyl)-CoA
  • Coenzyme A (Z)-S-9-octadecenoate
  • Coenzyme A, S-oleate (7CI,8CI)
  • 6541AH
  • EX-A10803
  • LMFA07050356
  • MFCD00871328
  • Cis-9-octadecenoyl coenzyme a potassium salt
  • CID5497111
  • NO47203
  • NO63224
  • Coenzyme A, S-9-octadecenoate, (Z)-
  • S-((9Z)-octadec-9-enoyl)-coenzyme A
  • 3-methylquinazoline-2,4(1H,3H)-dione
  • C39-H68-N7-O17-P3-S
  • HY-109591
  • J203.108F
  • CS-0032765
  • FT-0771309
  • Coenzyme A, S-(9Z)-9-octadecenoate (9CI)
  • C00510
  • 10898-EP2269610A2
  • 10898-EP2289510A1
  • 10898-EP2301923A1
  • 10898-EP2316457A1
  • 10898-EP2316458A1
  • 10898-EP2316825A1
  • 10898-EP2316826A1
  • 10898-EP2316827A1
  • 10898-EP2316828A1
  • Q27088172
  • S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (Z)-octadec-9-enethioate
  • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-{[2-({2-[(9Z)-octadec-9-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(9Z)-octadec-9-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}
  • S-{(3r,5r,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-3lambda~5~,5lambda~5~-Diphosphaheptadecan-17-Yl} (9z)-Octadec-9-Enethioate (Non-Preferred Name)
  • 18:1, oleoyl-CoA 9-[5-O-[hydroxy[[hydroxy[[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[[2-[[(9Z)-1-oxo-9-octadecenyl]thio]ethyl]amino]propyl]amino]butyl]oxy]phosphinyl]oxy]phosphinyl]-3-O-phosphon
  • 216-998-8
  • 3'-phosphoadenosine 5'-(3-((3R)-3-hydroxy-2,2-dimethyl-4-((3-((2-(((9Z)-octadec-9-enoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-4-oxobutyl) dihydrogen diphosphate)
  • 369657-01-2
  • 3VV
  • Adenosine 3 -phosphoric acid 5 -[diphosphoric acid P2-[(R)-3-hydroxy-4-[[3-[[2-[(Z)-9-octadecenoylthio]ethyl]amino]-3-oxopropyl]amino]-2,2-dimethyl-4-oxobutyl]] ester
  • S-(2-(3-(((2R)-4-((((2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl)methoxy-hydroxyphosphoryl)oxy-hydroxyphosphoryl)oxy-2-hydroxy-3,3-dimethylbutanoyl)amino)propanoylamino)ethyl) (Z)-octadec-9-enethioate
  • S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) (Z)-octadec-9-enethioate
  • S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5,10,14-tetraoxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} (9Z)-octadec-9-enethioate