![Chemical structure of (3S,5R,6E)-7-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoic Acid Calcium Salt, CAS 254452-88-5](https://api.angenesci.com/structure/1173/254452-88-5.png)
| CAS Number | 254452-88-5 |
| Catalog Number | AG00C2ZM(AGN-PC-0WG7DV) |
| Chemical Name | (3S,5R,6E)-7-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3,5-dihydroxy-6-heptenoic Acid Calcium Salt |
| IUPAC Name | (E,3S,5R)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoic acid |
| InChI | InChI=1S/C25H24FNO4/c26-17-9-7-15(8-10-17)24-20-3-1-2-4-22(20)27-25(16-5-6-16)21(24)12-11-18(28)13-19(29)14-23(30)31/h1-4,7-12,16,18-19,28-29H,5-6,13-14H2,(H,30,31)/b12-11+/t18-,19-/m0/s1 |
| InChI Key | VGYFMXBACGZSIL-JUFISIKESA-N |
| MDL Number | MFCD28138314 |
| Molecular Formula | C25H24CaFNO4 |
| Molecular Weight | 461.5388 |
| SMILES | c1ccc2c(c1)c(c(c(n2)C3CC3)/C=C/[C@@H](C[C@@H](CC(=O)O)O)O)c4ccc(cc4)F.[Ca] |
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