Chemical Compound
{[(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-[(3-methylbut-2-enoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
CAS Registry Number
6712-03-4
Primary record
{[(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-[(3-methylbut-2-enoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
- 库存
- 8,595 克
- 纯度
- 98.9 %
- CAS
- 6712-03-4
化合物标识与属性
- CAS
- 6712-03-4
- PubChem CID
- 9549326
- SMILES
- CC(=CC(=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)C
- Canonical SMILES
- CC(C)=CC(=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
- 3-methylbut-2-enoyl-CoA
- 3-methylcrotonyl-CoA
- Dimethylacryloyl-CoA
- DMA-CoA
- 3,3-dimethacrylyl-CoA
- 3-Methylcrotonyl CoA
- 3-Methylcrotonoyl-CoA
- beta,beta-dimethacrylyl-CoA
- beta-methylcrotonoyl-CoA
- 3,3-dimethacrylyl-coenzyme A
- 3-methyl-2-butenoyl-CoA
- Dimethylacryloyl-Coenzyme A
- RefChem:94865
- 3-methylcrotonyl-Coenzyme A
- beta,beta-dimethacrylyl-coenzyme A
- 3-Methylcrotonoyl-Coenzyme A
- S-(3-methylcrotonoyl)-coenzyme-A
- SZF9DF83AS
- 3-Methyl-2-butenoyl CoA
- S-(3-Methyl-crotonoyl)-coenzym-A
- 3-Methylcrotonyl coenzyme A
- beta-methylcrotonoyl-Coenzyme A
- beta-Methylcrotonylcoenzyme A
- 3-Methylbut-2-enoyl-Coenzyme A
- CHEBI:15486
- SCHEMBL1265972
- SCHEMBL29425225
- b-Methylcrotonyl-CoA (HMDB01493
- DTXSID801343051
- beta-Methylcrotonyl-CoA (HMDB01493
- ZINC8551513
- Coenzyme A, S-(3-methylcrotonate)
- LMFA07050232
- S-(3-Methyl-2-butenoyl)coenzyme A
- b-Methylcrotonyl-Coenzyme A (HMDB01493
- CID9549326
- Coenzyme A, S-(3-methyl-2-butenoate)
- beta-Methylcrotonyl-Coenzyme A (HMDB01493
- J675.059A
- C03069
- Q27089470
- 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(3-methylbut-2-enoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}
- 6712-03-4
- 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] 3-methylbut-2-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) 3-methylbut-2-enethioate
- (((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(((hydroxy(((hydroxy(3-hydroxy-2,2-dimethyl-3-((2-((2-((3-methylbut-2-enoyl)sulfanyl)ethyl)carbamoyl)ethyl)carbamoyl)propoxy)phosphoryl)oxy))phosphoryl)oxy)methyl)oxolan-3-yl)oxy)phosphonic acid
- {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({[hydroxy(3-hydroxy-2,2-dimethyl-3-{[2-({2-[(3-methylbut-2-enoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
- {[(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-[(3-methylbut-2-enoyl)sulfanyl]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-((3-methylbut-2-enoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-4-oxobutyl) dihydrogen diphosphate)
- 793193-48-3
- Adenosine 3 -phosphoric acid 5 -[diphosphoric acid beta-[(R)-3-hydroxy-2,2-dimethyl-4-[[3-[[2-(3-methyl-2-butenoylthio)ethyl]amino]-3-oxopropyl]amino]-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) 3-methylbut-2-enethioate