VPC 51299

Catalog NumberBL-M000845
CAS Number1004787-61-4
DescriptionVPC51299 is an effective low micromolar inhibitor containing vinyl phosphonate head groups.
IUPAC Name[(E,3R)-3-(hexadecanoylamino)-4-[4-[[4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methoxy]phenyl]but-1-enyl]phosphonic acid
Synonyms(R,E)-(3-palmitamido-4-(4-((4-(2,2,2-trifluoroethoxy)pyridin-2-yl)methoxy)phenyl)but-1-en-1-yl)phosphonic acid
Molecular Weight670.74
Molecular FormulaC34H50F3N2O6P
Purity>99%
Density1.2±0.1 g/cm3
AppearancePowder
Shelf Life1 Year
StorageStore at -20°C
Percent CompositionC 60.88%, H 7.51%, F 8.50%, N 4.18%, O 14.31%, P 4.62%
Canonical SMILESCCCCCCCCCCCCCCCC(=O)NC(CC1=CC=C(C=C1)OCC2=NC=CC(=C2)OCC(F)(F)F)C=CP(=O)(O)O
InChIInChI=1S/C34H50F3N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-33(40)39-29(21-23-46(41,42)43)24-28-16-18-31(19-17-28)44-26-30-25-32(20-22-38-30)45-27-34(35,36)37/h16-23,25,29H,2-15,24,26-27H2,1H3,(H,39,40)(H2,41,42,43)/b23-21+/t29-/m0/s1
InChI KeyPHXJFMYKLBONBN-QWXNGLIISA-N

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