Fecosterol
(3S,5S,10S,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Fecosterol|Faecosterol|delta-8(24),28-Ergostadienol|24-Methylene-5alpha-cholest-8-en-3beta-ol|24-methylene-cholest-8-en-3beta-ol|5alpha-ergosta-8,24(28)-dien-3beta-ol|.DELTA.8,24(28)-ERGOSTADIENOL|Ergosta-8,24(28)-dien-3-ol, (3beta,5alpha)-|8 , -CHOLESTEN-24-METHYLENE-3-BETA-OL|24-methylidene-5alpha-cholest-8-en-3beta-ol|5alpha-Ergosta-8,24(24~1~)-dien-3beta-ol|(3beta,5alpha)-Ergosta-8,24(28)-dien-3-ol|Ergosta-8,24(28)-dien-3-ol, (3.beta.,5.alpha.)-|(3S,5S,10S,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol|8(9), (5-ALPHA)-CHOLESTEN-24-METHYLENE-3-BETA-OL|5.ALPHA.-ERGOSTA-8,24(28)-DIEN-3.BETA.-OL|8(9), (5-|A)-CHOLESTEN-24-METHYLENE-3-|A-OL|(3.BETA.,5.ALPHA.)-ERGOSTA-8,24(28)-DIEN-3-OL|(1R,3aR,5aS,7S,9aS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methyl-5-methylideneheptan-2-yl]-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol|(3S,5S,10S,13R,14R,17R)-10,13-dimethyl-17-((2R)-6-methyl-5-methylideneheptan-2-yl)-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta(a)phenanthren-3-ol|(3S,5S,10S,13R,14R,17R)-17-((1R)-1,5-DIMETHYL-4-METHYLENE-HEXYL)-10,13-DIMETHYL-2,3,4,5,6,7,11,12,14,15,16,17-DODECAHYDRO-1H-CYCLOPENTA(A)PHENANTHREN-3-OL|(3S,5S,10S,13R,14R,17R)-17-[(1R)-1,5-Dimethyl-4-methylene-hexyl]-10,13-dimethyl-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol|Fecosterol; Ergosta-8,24(28)-dien-3-ol, (3ss,5a)-; 5a-Ergosta-8,24(28)-dien-3ss-ol (8CI); (3ss,5a)-Ergosta-8,24(28)-dien-3-ol; Faecosterin; Fecosterin; Fecosterol; ?8,24(28)-Ergostadienol
| Molecular Formula | C28H46O |
|---|---|
| Molecular Weight | 398.35486 g/mol |
| LogP | 8.1 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.35486 |
| Monoisotopic Mass | 398.35486 |
| Heavy Atoms | 29 |
| Complexity | 672.0 |
Chemical Identifiers
| CAS Number | 516-86-9 |
|---|---|
| SMILES | C[C@H](CCC(=C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C |
| InChIKey | SLQKYSPHBZMASJ-QKPORZECSA-N |
Product Overview
Fecosterol (CAS 516-86-9), with molecular formula C28H46O and molecular weight 398.35486 g/mol. IUPAC: (3S,5S,10S,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.