2,3,4-Tri-O-benzoyl Propofol-Beta-D-glucuronide Methyl Ester

Analyte Name

2,3,4-Tri-O-benzoyl Propofol-beta-D-glucuronide Methyl Ester

Molecular Formula

C40H40O10

Molecular Weight

680.74

Accurate Mass

680.26

SMILES

CC(C)C1=C(O[C@@H]2O[C@H](C(OC)=O)[C@@H](OC(C3=CC=CC=C3)=O)[C@H](OC(C4=CC=CC=C4)=O)[C@H]2OC(C5=CC=CC=C5)=O)C(C(C)C)=CC=C1

InChI

InChI=1S/C40H40O10/c1-24(2)29-22-15-23-30(25(3)4)31(29)49-40-35(48-38(43)28-20-13-8-14-21-28)33(47-37(42)27-18-11-7-12-19-27)32(34(50-40)39(44)45-5)46-36(41)26-16-9-6-10-17-26/h6-25,32-35,40H,1-5H3/t32?,33?,34?,35?,40-/m1/s1

IUPAC

(2S,3R,4S,5S,6S)-2-(2,6-diisopropylphenoxy)-6-(methoxycarbonyl)tetrahydro-2H-pyran-3,4,5-triyl tribenzoate

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat