| 2D Structure | |
| CID | 91472 |
| Target | / |
| IUPAC Name | (4R,4aS,6aS,6aS,6bR,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one |
| InChI | InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/t20-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1 |
| InChI Key | OFMXGFHWLZPCFL-SVRPQWSVSA-N |
| Canonical SMILES | CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C |
| Isomeric SMILES | C[C@H]1C(=O)CC[C@@H]2[C@@]1(CC[C@H]3[C@]2(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C)C)C)C)C |
| Molecular Formula | C30H50O |
| Molecular Weight | 426.7 |
| synonyms | ['Friedelin', '559-74-0', 'Friedeline', 'friedelanone', '(-)-Friedelin', 'D:A-Friedooleanan-3-one', 'EINECS 209-205-1', 'UNII-AK21264UAD', 'AK21264UAD', 'CHEBI:5171', '3-OXOFRIEDELANE', 'FRIEDELIN [MI]', 'NSC 55141', 'DTXSID101015732', 'NSC-55141', '(4R,4aS,6aS,6bR,8aR,12aR,12bS,14aS,14bS)-4,4a,6b,8a,11,11,12b,14a-octamethylicosahydropicen-3(2H)-one', '24,25,26-TRINOROLEANAN-3-ONE, 5,9,13-TRIMETHYL-, (4.BETA.,5.BETA.,8.ALPHA.,9.BETA.,10.ALPHA.,13.ALPHA.,14.BETA.)-', '3(2H)-PICENONE, EICOSAHYDRO-4,4A,6B,8A,11,11,12B,14A-OCTAMETHYL-, (4R-(4.ALPHA.,4A.ALPHA.,6A.BETA.,6B.ALPHA.,8A.ALPHA.,12A.ALPHA.,12B.BETA.,14A.ALPHA.,14B.BETA.))-', 'DTXCID901473918', '24,25,26-trinoroleanan-3-one, 5,9,13-trimethyl-, (4beta,5beta,8alpha,9beta,10alpha,13alpha,14beta)-', 'D:A-Friedooleanan-3-one (VAN) (8CI)', 'D:A-Friedooleanan-3-one (VAN) (8CI)(9CI)', '3(2H)-PICENONE, EICOSAHYDRO-4,4A,6B,8A,11,11,12B,14A-OCTAMETHYL-, (4R-(4ALPHA,4AALPHA,6ABETA,6BALPHA,8AALPHA,12AALPHA,12BBETA,14AALPHA,14BBETA))-', 'ofmxgfhwlzpcfl-uhfffaoysa-n', 'Friedelan-3-one', 'CHEMBL485998', '(4R,4aS,6aS,6aS,6bR,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one', '24,25,26-Trinoroleanan-3-one, 5,9,13-trimethyl-,(4b,5b,8a,9b,10a,13a,14b)-', 'SR-05000002227', 'Fridelin', 'MFCD00017296', 'Friedelin (Standard)', 'Friedelin, technical grade', 'Friedelin, analytical standard', 'SCHEMBL193053', 'HY-N4110R', 'D:A-Friedooleanan-3-one (VAN)', 'OFMXGFHWLZPCFL-SVRPQWSVSA-N', 'HY-N4110', 'BDBM50241943', 'AKOS015897124', 'CCG-208470', 'FF66091', 'MS-27536', 'CS-0032118', 'NS00043099', 'C08626', 'SR-05000002227-2', 'SR-05000002227-3', 'Q15410972', '3(2H)-Picenone, eicosahydro-4,4a,6b,8a,11,11,12b,14a-octamethyl-, (4R,4aS,6aS,6bR,8aR,12aR,12bS,14aS,14bS)-'] |
From Pubchem