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PFB-FDGlu

CAT: 1410-M35123-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M35123-02Size:5 mg
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Description
PFB-FDGlu is a lysosomal Glucocerebrosidase (GCase) substrate with cell-permeable specificity that is cleaved to produce fluorescein.PFB-FDGlu is often used in conjunction with a flow cytometer to measure GCase activity in living cells on an individual cell basis.
CAS Number
209540-62-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
865.66
Molecular Formula
C39H32F5NO16
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

PFB-FDGlu
CAS Number209540-62-5
PubChem CID18661147
IUPAC Name2,3,4,5,6-pentafluoro-N-[3-oxo-3',6'-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]spiro[2-benzofuran-1,9'-xanthene]-5-yl]benzamide
Molecular FormulaC39H32F5NO16
Molecular Weight865.7
XLogP1.2
Topological Polar Surface Area263
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count21
Rotatable Bond Count8
Heavy Atom Count61
Formal Charge0
Complexity1500
SMILES
C1=CC2=C(C=C1NC(=O)C3=C(C(=C(C(=C3F)F)F)F)F)C(=O)OC24C5=C(C=C(C=C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)OC7=C4C=CC(=C7)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O
InChI
InChI=1S/C39H32F5NO16/c40-24-23(25(41)27(43)28(44)26(24)42)35(54)45-12-1-4-16-15(7-12)36(55)61-39(16)17-5-2-13(56-37-33(52)31(50)29(48)21(10-46)59-37)8-19(17)58-20-9-14(3-6-18(20)39)57-38-34(53)32(51)30(49)22(11-47)60-38/h1-9,21-22,29-34,37-38,46-53H,10-11H2,(H,45,54)/t21-,22-,29-,30-,31+,32+,33-,34-,37-,38-/m1/s1
InChIKey
YYMJMZGTQFITLS-WXKYVOLFSA-N
Chemical Structure
2D Structure
2D structure of PFB-FDGlu
CAS: 209540-62-5
CID: 18661147
Formula: C39H32F5NO16
MW: 865.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight865.7
XLogP31.2
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count21
Rotatable Bond Count8
Exact Mass865.16412474
Monoisotopic Mass865.16412474
Topological Polar Surface Area263 Ų
Heavy Atom Count61
Formal Charge0
Complexity1500
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes