(8R)-heptacosan-8-ol
PubChem CID: 163042856
Connections displayed (default: 10).
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| Topological Polar Surface Area | 20.2 |
|---|---|
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 28.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 263.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (8R)-heptacosan-8-ol |
| Prediction Hob | 0.0 |
| Xlogp | 12.9 |
| Molecular Formula | C27H56O |
| Prediction Swissadme | 0.0 |
| Inchi Key | AXIUITXPKVUQFF-HHHXNRCGSA-N |
| Fcsp3 | 1.0 |
| Logs | -3.397 |
| Rotatable Bond Count | 24.0 |
| Logd | 1.267 |
| Compound Name | (8R)-heptacosan-8-ol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 396.433 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 396.433 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 396.7 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -8.868012800000002 |
| Inchi | InChI=1S/C27H56O/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-22-24-26-27(28)25-23-21-8-6-4-2/h27-28H,3-26H2,1-2H3/t27-/m1/s1 |
| Smiles | CCCCCCCCCCCCCCCCCCC[C@@H](CCCCCCC)O |
| Nring | 4.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Aloe Microstigma (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Chrozophora Prostrata (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Papaver Somniferum (Plant) Rel Props:Source_db:cmaup_ingredients