1-Eicosanol, 1-(hydrogen sulfate)
PubChem CID: 83208
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 1-Eicosanol, hydrogen sulfate, 67633-89-0, Arachidyl monosulfate, 1-Eicosanol, 1-(hydrogen sulfate), EINECS 266-790-6, DTXSID4070538, Icosan-1-yl hydrogen sulfate, Icosan-1-yl hydrogen sulphate, SCHEMBL143597, DTXCID5044946, DLFKFFZPKVOYJI-UHFFFAOYSA-N, NS00036140 |
|---|---|
| Prediction Swissadme | 0.0 |
| Topological Polar Surface Area | 72.0 |
| Hydrogen Bond Donor Count | 1.0 |
| Inchi Key | DLFKFFZPKVOYJI-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Rotatable Bond Count | 20.0 |
| Heavy Atom Count | 25.0 |
| Compound Name | 1-Eicosanol, 1-(hydrogen sulfate) |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 378.28 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 378.28 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 349.0 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 378.6 |
| Database Name | cmaup_ingredients;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | icosyl hydrogen sulfate |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Prediction Hob | 0.0 |
| Esol | -6.587837799999999 |
| Inchi | InChI=1S/C20H42O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-25(21,22)23/h2-20H2,1H3,(H,21,22,23) |
| Smiles | CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O |
| Xlogp | 9.1 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C20H42O4S |
- 1. Outgoing r'ship
FOUND_INto/from Chaenomeles Sinensis (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Tylophora Ovata (Plant) Rel Props:Source_db:cmaup_ingredients