Solanesol (Nonaisoprenol)

Chemical Information
Solanesol is a nonaprenol that is hexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-ol substituted by 9 methyl groups at positions 3, 7, 11, 15, 19, 23, 27, 31 and 35 (the all-trans0stereoisomer). It has a role as a plant metabolite. It is a primary alcohol and a nonaprenol.
| CAS Number | 13190-97-1 |
| PubChem CID | 5477212 |
| IUPAC Name | (2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-ol |
| Molecular Formula | C45H74O |
| Molecular Weight | 631.1 |
| XLogP | 15.9 |
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 25 |
| Heavy Atom Count | 46 |
| Formal Charge | 0 |
| Complexity | 1100 |
| Property | Value |
|---|---|
| Molecular Weight | 631.1 |
| XLogP3 | 15.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 25 |
| Exact Mass | 630.57396698 |
| Monoisotopic Mass | 630.57396698 |
| Topological Polar Surface Area | 20.2 Ų |
| Heavy Atom Count | 46 |
| Formal Charge | 0 |
| Complexity | 1100 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 8 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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