
| CAS Number | 155683-61-7 |
| Catalog Number | AG00ADFB(AGN-PC-0WH2WO) |
| Chemical Name | 4-Methyl Ethynyl Estradiol |
| IUPAC Name | (8R,9S,13S,14S,17R)-17-ethynyl-4,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol |
| InChI | InChI=1S/C21H26O2/c1-4-21(23)12-10-18-17-6-5-14-13(2)19(22)8-7-15(14)16(17)9-11-20(18,21)3/h1,7-8,16-18,22-23H,5-6,9-12H2,2-3H3/t16-,17-,18+,20+,21+/m1/s1 |
| InChI Key | GJUXDWYIPYRJJU-SACAXFFCSA-N |
| MDL Number | MFCD16294893 |
| Molecular Formula | C21H26O2 |
| Molecular Weight | 310.4299 |
| SMILES | Cc1c(O)ccc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#C)[C@@H]3CCc12 |
| UNII | W12GK7503E |
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