1-Octatriacontanol
PubChem CID: 13847926
Connections displayed (default: 10).
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| Compound Synonyms | 1-Octatriacontanol, UNII-2HOO57W317, 141885-88-3, 2HOO57W317, DTXSID80161845, SCHEMBL235224, DTXCID7084336, Q27254758 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 39.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 392.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | octatriacontan-1-ol |
| Prediction Hob | 0.0 |
| Xlogp | 19.2 |
| Molecular Formula | C38H78O |
| Prediction Swissadme | 0.0 |
| Inchi Key | ZWWTXCMUMXNPPD-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -8.1 |
| Rotatable Bond Count | 36.0 |
| Logd | 5.037 |
| Compound Name | 1-Octatriacontanol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 550.605 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 550.605 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 551.0 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -12.869354200000004 |
| Inchi | InChI=1S/C38H78O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39/h39H,2-38H2,1H3 |
| Smiles | CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Annona Muricata (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Boehmeria Pannosa (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Cirsium Carolinianum (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Dipentodon Sinicus (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Pericome Caudata (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Piper Lanceifolium (Plant) Rel Props:Source_db:cmaup_ingredients