Pollinasterol
PubChem CID: 565570
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| Compound Synonyms | Pollinasterol, HXQRIQXPGMPSRW-UHFFFAOYSA-N, 9,19-Cyclo-14-methylcholestan-3-ol, 9,19-Cyclocholestan-3-ol, 14-methyl-, (3.beta.,5.alpha.)-, 9,19-Cyclo-5.alpha.,9.beta.-cholestan-3.beta.-ol, 14-methyl-, 1-(1,5-Dimethylhexyl)-3a,12a-dimethyltetradecahydro-1H-cyclopenta[a]cyclopropa[e]phenanthren-7-ol # |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Inchi Key | HXQRIQXPGMPSRW-UHFFFAOYSA-N |
| Rotatable Bond Count | 5.0 |
| Synonyms | 9,19-Cyclo-14-methylcholestan-3-ol, Pollinasterol |
| Heavy Atom Count | 29.0 |
| Compound Name | Pollinasterol |
| Description | Isolated from Smilax medica (Sarsaparilla). Pollinastanol is found in dandelion. |
| Exact Mass | 400.371 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 400.371 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 640.0 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 400.7 |
| Database Name | fooddb_chem_all;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 12,16-dimethyl-15-(6-methylheptan-2-yl)pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol |
| Total Atom Stereocenter Count | 9.0 |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/C28H48O/c1-19(2)7-6-8-20(3)23-12-13-26(5)24-10-9-21-17-22(29)11-14-27(21)18-28(24,27)16-15-25(23,26)4/h19-24,29H,6-18H2,1-5H3 |
| Smiles | CC(C)CCCC(C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5)O)C)C |
| Xlogp | 9.4 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C28H48O |
- 1. Outgoing r'ship
FOUND_INto/from Taraxacum Officinale (Plant) Rel Props:Source_db:fooddb_chem_all