(5Z)-rel-Cloprostenol Sodium

Analyte Name

Cloprostenol Sodium

CAS Number

55028-72-3

Molecular Formula

C22 H28 Cl O6 . Na

Molecular Weight

446.90

Accurate Mass

446.1472

SMILES

[Na+].O[C@@H](COc1cccc(Cl)c1)\C=C\[C@H]2[C@H](O)C[C@H](O)[C@@H]2C\C=C/CCCC(=O)[O-]

InChI

/q, +1/p-1/b3-1-,11-10+, InChI=1S/C22H29ClO6.Na/c23-15-6-5-7-17(12-15)29-14-16(24)10-11-19-18(20(25)13-21(19)26)8-3-1-2-4-9-22(27)28, /m1./s1, /h1,3,5-7,10-12,16,18-21,24-26H,2,4,8-9,13-14H2,(H,27,28), /t16-,18-,19-,20+,21-

IUPAC

sodium;(Z)-7-[(1R,2R,3R,5S)-2-[(E,3R)-4-(3-chlorophenoxy)-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]hept-5-enoate

Alternate CAS Number

Free base: 40665-92-7

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Impurity

Product Format

Neat

API Family

Cloprostenol Sodium; Cloprostenol

Purity

>95% (HPLC)