CID 21588174
PubChem CID: 21588174
Connections displayed (default: 10).
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| Topological Polar Surface Area | 74.8 |
|---|---|
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 22.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 296.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | heptadecyl sulfate |
| Prediction Hob | 0.0 |
| Xlogp | 7.4 |
| Molecular Formula | C17H35O4S- |
| Prediction Swissadme | 0.0 |
| Inchi Key | KGIBGHABTNQVJX-UHFFFAOYSA-M |
| Fcsp3 | 1.0 |
| Logs | -2.676 |
| Rotatable Bond Count | 16.0 |
| Logd | 3.468 |
| Compound Name | CID 21588174 |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 335.226 |
| Formal Charge | -1.0 |
| Monoisotopic Mass | 335.226 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 335.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.491785999999999 |
| Inchi | InChI=1S/C17H36O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-22(18,19)20/h2-17H2,1H3,(H,18,19,20)/p-1 |
| Smiles | CCCCCCCCCCCCCCCCCOS(=O)(=O)[O-] |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Galeola Faberi (Plant) Rel Props:Source_db:cmaup_ingredients