For research use only. Not for therapeutic Use.
Catalog Number | R015793 |
CAS Number | 20592-42-1 |
Synonyms | Estra-1,3,5(10),16-tetraene-3,17-diol Diacetate ; NSC 97079 |
Molecular Formula | C22H26O4 |
Purity | ≥95% |
Storage | -20°C |
IUPAC Name | [(8R,9S,13S,14S)-3-acetyloxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] acetate |
InChI | InChI=1S/C22H26O4/c1-13(23)25-16-5-7-17-15(12-16)4-6-19-18(17)10-11-22(3)20(19)8-9-21(22)26-14(2)24/h5,7,9,12,18-20H,4,6,8,10-11H2,1-3H3/t18-,19-,20+,22+/m1/s1 |
InChIKey | KPJNGUPMJAHAND-JBPLPALLSA-N |
SMILES | CC(=O)OC1=CCC2C1(CCC3C2CCC4=C3C=CC(=C4)OC(=O)C)C |