Basic information
- CAS
50614-00-1- Standard SMILES
CCC(C)C1(CCCCCCCCCCCCC(=O)O)OCC(C)(C)N1[O]- InChIKey
BOHLTFTYSPMNOW-UHFFFAOYSA-N- Molecular formula
- C22H42NO4
- Average molar mass
- 384.6 g/mol
- Monoisotopic mass
- 384.31138382
Names & identifiers
- Preferred name
- 14-Doxylstearic acid
- IUPAC
- [2-(Butan-2-yl)-2-(12-carboxydodecyl)-4,4-dimethyl-1,3-oxazolidin-3-yl]oxidanyl
- English name
- 14-Doxylstearic Acid
- Molecular formula
- C22H42NO4
- Molecular weight
- 384.57
Names & synonyms
14-Doxyl stearic acid3-Oxazolidinyloxy, 2-(1-butyl-13-carboxytridecyl)-4,4-dimethyl-RefChem:7862061443-70-714-Doxylstearic acid50614-00-1[2-(butan-2-yl)-2-(12-carboxydodecyl)-4,4-dimethyl-1,3-oxazolidin-3-yl]oxidanylDTXSID4096485413-(2-butan-2-yl-3-$l^{1}2-Butyl-2-(12-carboxydodecyl)-4,4-dimethyl-3-oxazolidinyloxyXECUKVYGDSBOGP-UHFFFAOYSA-N3-Oxazolidinyloxy, 2-butyl-2-(12-carboxydodecyl)-4,4-dimethyl-
Database identifiers
- CAS
50614-00-1- PubChem CID
- 189124
- DTXSID
DTXSID40964854
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 15
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 427
Chemistry & industry
Applications
Uses14-Doxylstearic Acid is a spin-labeled fatty acid. The reduction of doxylstearates takes place at the level of the ubiquinone in the respiratory chain in mitochondria in these cells.
Suppliers4 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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