Faradiol
(3S,4aR,6aR,6aR,6bR,8S,8aS,12S,12aS,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,6a,7,8,9,12,12a,13,14,14a-tetradecahydro-1H-picene-3,8-diol
Also Known As: Faradiol|Urs-20-ene-3,16-diolato|KST-1A2641|18alpha,19betaH-Urs-20-ene-3beta,16beta-diol|(9xi)-19alpha-Urs-20-ene-3beta,16beta-diol|(3S,4aR,6aR,6bR,8S,8aS,12S,12aS,12bR,14bR)-4,4,6a,6b,8a,11,12,14b-Octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,12,12a,12b,13,14,14a,14b-eicosahydro-picene-3,8-diol|(3S,4aR,6aR,6aR,6bR,8S,8aS,12S,12aS,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,6a,7,8,9,12,12a,13,14,14a-tetradecahydro-1H-picene-3,8-diol|(3beta,12beta,18alpha,19alpha)-Urs-20-ene-3,12-diol|Urs-20-ene-3,16-diol, (3.beta.,16.beta.,18.alpha.,19.alpha.)-
| Molecular Formula | C30H50O2 |
|---|---|
| Molecular Weight | 442.38107 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 442.38107 |
| Heavy Atoms | 32 |
| Complexity | 813.6 |
Chemical Identifiers
| CAS Number | 20554-95-4 |
|---|---|
| SMILES | C[C@H]1[C@H]2[C@H]3CCC4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(C[C@@H]([C@]2(CC=C1C)C)O)C)C)(C)C)O)C |
Product Overview
Faradiol (CAS 20554-95-4), with molecular formula C30H50O2 and molecular weight 442.38107 g/mol. IUPAC: (3S,4aR,6aR,6aR,6bR,8S,8aS,12S,12aS,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,6a,7,8,9,12,12a,13,14,14a-tetradecahydro-1H-picene-3,8-diol.
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