CAS 944031-56-5 appears in our catalog under these names: Betamethasone Impurity 84, 16alpha-Homo 2-(Hydroxymethyl)betamethasone. Offered by: Chemat Brand, TRC. Available pack sizes: on request, 5mg.
(2S,3S,4aS,4bS,10aS,10bR,11S,12aS)-10b-fluoro-2,11-dihydroxy-2-(hydroxymethyl)-3,10a,12a-trimethyl-3,4,4a,4b,5,6,11,12-octahydrochrysene-1,8-dione (CAS 944031-56-5) is a chemical compound with the molecular formula C22H29FO5 and a molecular weight of 392.5 g/mol. IUPAC name: (2S,3S,4aS,4bS,10aS,10bR,11S,12aS)-10b-fluoro-2,11-dihydroxy-2-(hydroxymethyl)-3,10a,12a-trimethyl-3,4,4a,4b,5,6,11,12-octahydrochrysene-1,8-dione. InChIKey: FOCFAOIORDLAJM-JQGIEVFVSA-N.
| Molecular formula | C22H29FO5 |
|---|---|
| Molecular weight | 392.5 g/mol |
| IUPAC name | (2S,3S,4aS,4bS,10aS,10bR,11S,12aS)-10b-fluoro-2,11-dihydroxy-2-(hydroxymethyl)-3,10a,12a-trimethyl-3,4,4a,4b,5,6,11,12-octahydrochrysene-1,8-dione |
| InChIKey | FOCFAOIORDLAJM-JQGIEVFVSA-N |
| SMILES | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2(C(=O)[C@]1(CO)O)C)O)F)C |
Computed by PubChem (NCBI)