Primary record
2-[2-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-2-oxoethyl]-2-hydroxybutanedioic acid
- 库存
- 7,766 克
- 纯度
- 99.7 %
- CAS
- 3131-26-8
化合物标识与属性
- CAS
- 3131-26-8
- PubChem CID
- 3081994
- SMILES
- CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CC(CC(=O)O)(C(=O)O)O)O
- Canonical SMILES
- CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)CC(O)(CC(=O)O)C(=O)O
名称与同义词
- Citryl-coa
- Citryl-coenzyme A
- (3S)-Citryl-CoA
- Coenzyme A, citryl-
- AC1MIXYD
- RefChem:126613
- SCHEMBL4356344
- C27H42N7O22P3S
- DTXSID10953351
- CID3081994
- C27-H42-N7-O22-P3-S
- 3131-26-8
- Coenzyme A, S-(2,3-dihydrogen 2-hydroxy-1,2,3-propanetricarboxylate)
- 2-[2-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-2-oxoethyl]-2-hydroxybutanedioic acid
- 9-{5-O-[{[(4-{[3-({2-[(3,4-Dicarboxy-3-hydroxybutanoyl)sulfanyl]ethyl}imino)-3-hydroxypropyl]imino}-3,4-dihydroxy-2,2-dimethylbutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H-purin-6-amine