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JF526–Pepstatin A TFA

CAT: 0013-GTR19318800Size: 100 µgDry Ice: NoHazardous: No
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CAT#:0013-GTR19318800Size:100 µg
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Description
JF526–Pepstatin A TFA is a fluorescent probe designed for live-cell lysosomal labeling, with peak excitation at 530 nm and emission at 549 nm. It is widely applied in autophagy and lysosomal function studies, supporting both in vitro and in vivo research models.
CAS Number
2410614-07-0
Field of Research
Immunology & Inflammation
Molecular Weight
1442.51
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

JF526-Pepstatin A (TFA)
CAS Number2410614-07-0
PubChem CID172638579
IUPAC Name2-[3-(3,3-difluoroazetidin-1-ium-1-ylidene)-6-(3,3-difluoroazetidin-1-yl)-2,7-difluoroxanthen-9-yl]-4-[6-[[(3S,4S)-3-hydroxy-4-[[(2S)-2-[[(3S,4S)-3-hydroxy-6-methyl-4-[[(2S)-3-methyl-2-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]butanoyl]amino]heptanoyl]amino]propanoyl]amino]-6-methylheptanoyl]amino]hexylcarbamoyl]benzoic acid;2,2,2-trifluoroacetate
Molecular FormulaC69H92F9N9O14
Molecular Weight1442.5
Topological Polar Surface Area337
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count24
Rotatable Bond Count33
Heavy Atom Count101
Formal Charge0
Complexity2840
SMILES
C[C@@H](C(=O)N[C@@H](CC(C)C)[C@H](CC(=O)NCCCCCCNC(=O)C1=CC(=C(C=C1)C(=O)O)C2=C3C=C(C(=[N+]4CC(C4)(F)F)C=C3OC5=CC(=C(C=C52)F)N6CC(C6)(F)F)F)O)NC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)CC(C)C)O.C(=O)(C(F)(F)F)[O-]
InChI
InChI=1S/C67H91F6N9O12.C2HF3O2/c1-34(2)20-47(77-61(88)39(11)76-57(87)29-52(84)48(21-35(3)4)78-63(90)60(38(9)10)80-64(91)59(37(7)8)79-56(86)22-36(5)6)51(83)28-55(85)74-18-14-12-13-15-19-75-62(89)40-16-17-41(65(92)93)42(23-40)58-43-24-45(68)49(81-30-66(70,71)31-81)26-53(43)94-54-27-50(46(69)25-44(54)58)82-32-67(72,73)33-82;3-2(4,5)1(6)7/h16-17,23-27,34-39,47-48,51-52,59-60,83-84H,12-15,18-22,28-33H2,1-11H3,(H7-,74,75,76,77,78,79,80,85,86,87,88,89,90,91,92,93);(H,6,7)/t39-,47-,48-,51-,52-,59-,60-;/m0./s1
InChIKey
JONSFJPZCPEZFP-WKVYEHBGSA-N
Chemical Structure
2D Structure
2D structure of JF526-Pepstatin A (TFA)
CAS: 2410614-07-0
CID: 172638579
Formula: C69H92F9N9O14
MW: 1442.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1442.5
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count24
Rotatable Bond Count33
Exact Mass1441.66200210
Monoisotopic Mass1441.66200210
Topological Polar Surface Area337 Ų
Heavy Atom Count101
Formal Charge0
Complexity2840
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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