Chemical Compound
2-aminobenzoylacetyl-CoA
CAS Registry Number
1812866-39-9
Primary Record
2-aminobenzoylacetyl-CoA
- In stock
- 5,618 g
- Purity
- 99.1 %
- CAS
- 1812866-39-9
Compound Identifiers & Properties
- CAS
- 1812866-39-9
- PubChem CID
- 118797972
- SMILES
- CC(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)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC(=O)C4=CC=CC=C4N)O
- Canonical SMILES
- CC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)c1ccccc1N
Names & Synonyms
- 2-aminobenzoylacetyl-CoA
- RefChem:85367
- (2-aminobenzoyl)acetyl-CoA
- 2-aminobenzoylacetyl-coenzyme A
- CHEBI:131952
- orb3022237
- C21452
- Q27225319
- 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[3-(2-aminophenyl)-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
- 1812866-39-9
- 3'-phosphoadenosine 5'-(3-((3R)-4-((3-((2-((3-(2-aminophenyl)-3-oxopropanoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate)
- 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-(2-aminophenyl)-3-oxopropanethioate
- 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-(2-aminophenyl)-3-oxopropanethioate