Analyte Name

(Z)-Pitavastatin Calcium

CAS Number

1159588-21-2

Molecular Formula

2 C25 H23 F N O4 . Ca

Molecular Weight

880.984

Accurate Mass

880.285

SMILES

[Ca+2].O[C@H](C[C@H](O)\C=C/c1c(nc2ccccc2c1c3ccc(F)cc3)C4CC4)CC(=O)[O-].O[C@H](C[C@H](O)\C=C/c5c(nc6ccccc6c5c7ccc(F)cc7)C8CC8)CC(=O)[O-]

InChI

InChI=1S/2C25H24FNO4.Ca/c2*26-17-9-7-15(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;/h2*1-4,7-12,16,18-19,28-29H,5-6,13-14H2,(H,30,31);/q;;+2/p-2/b2*12-11-;/t2*18-,19-;/m11./s1

IUPAC

calcium;(Z,3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat