Pregnenolone acetate(1778-02-5) MS
Product NamePregnenolone acetate
CAS1778-02-5
Molecular FormulaC23H34O3
Molecular Weight358.51
InChIInChI=1/C23H34O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,17-21H,6-13H2,1-4H3/t17-,18-,19+,20-,21-,22-,23+/s3
InChIKey CRRKVZVYZQXICQ-UVQWRZATNA-N
Smiles[C@]12(C)CC[C@]3([H])[C@@]4(C)CC[C@H](OC(=O)C)CC4=CC[C@@]3([H])[C@]1([H])CC[C@@H]2C(=O)C |&1:0,4,6,10,19,21,25,r|
