(1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol
group of stereoisomers with the chemical formula C₂₈H₄₈O
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(1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol
Summary
(1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol is a group of stereoisomers[1].
Key Facts
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's instance of is recorded as group of stereoisomers[2].
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's canonical SMILES is recorded as OC1CCC2(C)C3C(=CCC2C1)C4CCC(C(C)CCC(C)C(C)C)C4(C)CC3[3].
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's InChI is recorded as InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h10,18-22,24-26,29H,7-9,11-17H2,1-6H3/t19?,20?,21?,22-,24+,25?,26?,27-,28+/m0/s1[4].
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's InChIKey is recorded as PUGBZUWUTZUUCP-LTHKAMRSSA-N[5].
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's chemical formula is recorded as C₂₈H₄₈O[6].
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's subclass of is recorded as ergostane steroid[7].
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's PubChem CID is recorded as 5317423[8].
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's isomeric SMILES is recorded as CC(C)C(C)CCC(C)[C@H]1CCC2C3=CCC4CC@@HCC[C@]4(C)C3CC[C@@]21C[9].
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+400.370516156'}[10].
- (1R,7S,9aS,11aR)-1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-ol's UniChem compound ID is recorded as 52216004[11].