Primary Record
2-Aza-butyryl CoA
- In stock
- 9,025 g
- Purity
- 99.6 %
- CAS
- 161112-52-3
Compound Identifiers & Properties
- CAS
- 161112-52-3
- PubChem CID
- 102122165
- SMILES
- CCNC(=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
- CCNC(=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
Names & Synonyms
- 2-Aza-butyryl CoA
- S-(Ethylcarbamoyl)coenzyme A
- orb3022216
- J978.603A
- {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-({[({[(3R)-3-{[2-({2-[(ethylcarbamoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
- 161112-52-3
- Adenosine 3 -phosphoric acid 5 -[diphosphoric acid beta-[(R)-3-hydroxy-2,2-dimethyl-4-[[3-[[2-(ethylcarbamoylthio)ethyl]amino]-3-oxopropyl]amino]-4-oxobutyl]] ester