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CHEBI:3078 - betamethasone sodium phosphate
| Formula | C22H28FO8P.2Na |
| Net Charge | 0 |
| Average Mass | 516.410 |
| Monoisotopic Mass | 516.13012 |
| SMILES | [H][C@@]12C[C@H](C)[C@](O)(C(=O)COP(=O)([O-])[O-])[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@@]21C.[Na+].[Na+] |
| InChI | InChI=1S/C22H30FO8P.2Na/c1-12-8-16-15-5-4-13-9-14(24)6-7-19(13,2)21(15,23)17(25)10-20(16,3)22(12,27)18(26)11-31-32(28,29)30;;/h6-7,9,12,15-17,25,27H,4-5,8,10-11H2,1-3H3,(H2,28,29,30);;/q;2*+1/p-2/t12-,15-,16-,17-,19-,20-,21-,22-;;/m0../s1 |
| InChIKey | PLCQGRYPOISRTQ-LWCNAHDDSA-L |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| betamethasone sodium phosphate (CHEBI:3078) has part betamethasone phosphate(2−) (CHEBI:68604) |
| betamethasone sodium phosphate (CHEBI:3078) is a organic sodium salt (CHEBI:38700) |
| betamethasone sodium phosphate (CHEBI:3078) is a tertiary α-hydroxy ketone (CHEBI:139592) |
| IUPAC Name |
|---|
| disodium 9-fluoro-11β,17-dihydroxy-16β-methyl-3,20-dioxopregna-1,4-dien-21-yl phosphate |
| Synonyms | Source |
|---|---|
| 9-Fluoro-11β,17,21-trihydroxy-16β-methylpregna-1,4-diene-3,20-dione 21-(disodium phosphate) | ChemIDplus |
| Betamethasone 21-disodium phosphate | ChemIDplus |
| Betamethazone disodium phosphate | ChemIDplus |