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EC359

CAT: 1410-M32901-01Size: 1 EachDry Ice: NoHazardous: No
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Description
EC359 is a potent and selective inhibitor of leukemia inhibitory factor receptor (LIFR), a potent inhibitor with anticancer activity, blocks LIF/LIFR interaction, and can be used in the study of leukemia and endometrial cancer.
CAS Number
2012591-09-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
540.68
Molecular Formula
C36H38F2O2
Notes
Research use only, not for human use.
Receptor
Apoptosis

Chemical Information

CID 139600278
CAS Number2012591-09-0
PubChem CID139600278
IUPAC Name(8S,11R,13S,14S,17S)-17-(1,1-difluoroprop-2-ynyl)-17-hydroxy-13-methyl-11-[4-(2,4,6-trimethylphenyl)phenyl]-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Molecular FormulaC36H38F2O2
Molecular Weight540.7
XLogP6.5
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count40
Formal Charge0
Complexity1140
SMILES
CC1=CC(=C(C(=C1)C)C2=CC=C(C=C2)[C@H]3C[C@]4([C@@H](CC[C@]4(C(C#C)(F)F)O)[C@H]5C3=C6CCC(=O)C=C6CC5)C)C
InChI
InChI=1S/C36H38F2O2/c1-6-36(37,38)35(40)16-15-31-29-13-11-26-19-27(39)12-14-28(26)33(29)30(20-34(31,35)5)24-7-9-25(10-8-24)32-22(3)17-21(2)18-23(32)4/h1,7-10,17-19,29-31,40H,11-16,20H2,2-5H3/t29-,30+,31-,34-,35-/m0/s1
InChIKey
AHHXLJGAODIDAX-WQQPUSSASA-N
Chemical Structure
2D Structure
2D structure of CID 139600278
CAS: 2012591-09-0
CID: 139600278
Formula: C36H38F2O2
MW: 540.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight540.7
XLogP36.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass540.28398677
Monoisotopic Mass540.28398677
Topological Polar Surface Area37.3 Ų
Heavy Atom Count40
Formal Charge0
Complexity1140
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BUP21773-01EC359

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