Friedelan-7-one
(4S,4aR,6aS,6aS,6bR,8aR,12aR,14aS,14bR)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,3,4,5,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-6-one
Also Known As: Friedelan-7-one|Putranjivone|7-Ketofriedelane|D:A-Friedooleanan-7-one|KST-1A2716|(4S,4aR,6aS,6aS,6bR,8aR,12aR,14aS,14bR)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,3,4,5,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-6-one|(4s,4ar,6as,6br,8ar,12ar,12bs,14as,14br)-4,4a,6b,8a,11,11,12b,14a-octamethylicosahydropicen-6(2h)-one|4,4a,6b,8a,11,11,12b,14a-Octamethylicosahydropicen-6(2H)-one|24,25,26-Trinoroleanan-7-one,5,9,13-trimethyl-, (4b,5b,8a,9b,10a,13a,14b)-|(4S,4AR,6AS,6BR,8AR,12AR,12BS,14AS,14BR)-4,4A,6B,8A,11,11,12B,14A-OCTAMETHYL-DOCOSAHYDROPICEN-6-ONE
| Molecular Formula | C30H50O |
|---|---|
| Molecular Weight | 426.38617 g/mol |
| LogP | 10.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 426.38617 |
| Monoisotopic Mass | 426.38617 |
| Heavy Atoms | 31 |
| Complexity | 781.0 |
Chemical Identifiers
| CAS Number | 2149-18-0 |
|---|---|
| SMILES | C[C@H]1CCC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@]2(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C)C)C)C)C |
| InChIKey | FCPANOBLGVXYMG-IIWBYEMSSA-N |
Product Overview
Friedelan-7-one (CAS 2149-18-0), with molecular formula C30H50O and molecular weight 426.38617 g/mol. IUPAC: (4S,4aR,6aS,6aS,6bR,8aR,12aR,14aS,14bR)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,3,4,5,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-6-one.