For research use only. Not for therapeutic Use.
| Catalog Number | L027487 |
| CAS Number | 62625-21-2 |
| Molecular Formula | C27H29NaO5S |
| Purity | ≥95% |
| IUPAC Name | sodium;4-[3-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]-5-methyl-2-propan-2-ylphenolate |
| InChI | InChI=1S/C27H30O5S.Na/c1-15(2)19-13-22(17(5)11-24(19)28)27(21-9-7-8-10-26(21)33(30,31)32-27)23-14-20(16(3)4)25(29)12-18(23)6;/h7-16,28-29H,1-6H3;/q;+1/p-1 |
| InChIKey | BAVBEHWEOJMHDS-UHFFFAOYSA-M |
| SMILES | CC1=CC(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C=C4C)[O-])C(C)C)C(C)C)O.[Na+] |
