Term: | Aragusteroketal |
|
Accession: | CHEBI:187381
|
browse the term
|
Synonyms: | exact_synonym: | (5S,8R,9S,10S,12R,13S,14S,17S)-17-[(2S,5R)-2-hydroxy-5-[(1R,2R)-2-methylcyclopropyl]hexan-2-yl]-3,3-dimethoxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-12-ol |
| related_synonym: | Formula=C31H54O4; InChI=1S/C31H54O4/c1-19(23-16-20(23)2)12-13-29(4,33)26-11-10-24-22-9-8-21-18-31(34-6,35-7)15-14-28(21,3)25(22)17-27(32)30(24,26)5/h19-27,32-33H,8-18H2,1-7H3/t19-,20-,21+,22+,23+,24+,25+,26-,27-,28+,29+,30+/m1/s1; InChIKey=YQWZCFGLCMVGHU-ZGYGCRBVSA-N; SMILES=O[C@H]1[C@]2([C@]([C@]3([C@@]([C@@]4([C@@](CC3)(CC(OC)(OC)CC4)[H])C)(C1)[H])[H])(CC[C@@]2([C@@](O)(CC[C@H]([C@]5([C@@H](C5)C)[H])C)C)[H])[H])C |
| xref: | Chemspider:27024664; LIPID_MAPS_instance:LMST01110016 |
|
|