Products for Research Use Only
RegisterLogin

Ezetimibe Hydroxy Glucuronide

CAT: 1299-RM-E262034-01Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1299-RM-E262034-01Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
536709-33-8
Synonyms
(2S,3S,4S,5R,6S) -6- ((S) -1- (4-fluorophenyl) -3- ((2S,3R) -1- (4-fluorophenyl) -2- (4-hydroxyphenyl) -4-oxoazetidin-3-yl) propoxy) -3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
Molecular Formula
C30H29F2NO9
Molecular Weight
585.56
Target Alternative Name
Ezetimibe
Product Name Synonym
(2S,3S,4S,5R,6S) -6- ((S) -1- (4-fluorophenyl) -3- ((2S,3R) -1- (4-fluorophenyl) -2- (4-hydroxyphenyl) -4-oxoazetidin-3-yl) propoxy) -3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid

Chemical Information

Ezetimibe hydroxy glucuronide
CAS Number536709-33-8
PubChem CID49849668
IUPAC Name(2S,3S,4S,5R,6R)-6-[(1S)-1-(4-fluorophenyl)-3-[(2S,3R)-1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular FormulaC30H29F2NO9
Molecular Weight585.5
XLogP2.6
Topological Polar Surface Area157
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count9
Heavy Atom Count42
Formal Charge0
Complexity920
SMILES
C1=CC(=CC=C1[C@@H]2[C@H](C(=O)N2C3=CC=C(C=C3)F)CC[C@@H](C4=CC=C(C=C4)F)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)O
InChI
InChI=1S/C30H29F2NO9/c31-17-5-1-15(2-6-17)22(41-30-26(37)24(35)25(36)27(42-30)29(39)40)14-13-21-23(16-3-11-20(34)12-4-16)33(28(21)38)19-9-7-18(32)8-10-19/h1-12,21-27,30,34-37H,13-14H2,(H,39,40)/t21-,22+,23-,24+,25+,26-,27+,30-/m1/s1
InChIKey
MPXLJVWGRVISEQ-ADEYADIWSA-N
Chemical Structure
2D Structure
2D structure of Ezetimibe hydroxy glucuronide
CAS: 536709-33-8
CID: 49849668
Formula: C30H29F2NO9
MW: 585.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight585.5
XLogP32.6
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count9
Exact Mass585.18103783
Monoisotopic Mass585.18103783
Topological Polar Surface Area157 Ų
Heavy Atom Count42
Formal Charge0
Complexity920
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
RM-E262166-01Ezetimibe-D4 Hydroxy Glucuronide
RM-E262035-01Ezetimibe Phenoxy Glucuronide
RM-E262164-01Ezetimibe-D4 Phenolic Glucuronide
RM-E262165-01Ezetimibe-D4 B-D-Glucuronide
RM-A150940-014'-Hydroxy Atomoxetine Glucuronide
RM-E262000-01Ezetimibe
RM-T162037-015-Hydroxy Tryptophol-O-Glucuronide
RM-D121867-013-Hydroxy Desloratadine-O-Glucuronide
RM-E262119-01Ezetimibe-D4
RM-E262001-01Ezetimibe Impurity A

Alternative Products

CatalogName
HY-135245-01Ezetimibe hydroxy glucuronide
011908Ezetimibe Hydroxy β-D-Glucuronide
AR-E10938-01Ezetimibe-d4 Hydroxy Glucuronide
293358-01Ezetimibe hydroxy-b-D-glucuronide
TRC-E975035-1MGEzetimibe Hydroxy Beta-D-Glucuronide
sc-218457Ezetimibe Hydroxy-d4 β-D-Glucuronide
TRC-E975037-75MGEzetimibe Hydroxy-d4 beta-D-Glucuronide
E9084-02Ezetimibe b-D-Glucuronide (Ezetimibe Phenoxy Glucuronide)
MBS5766630Ezetimibe phenoxy glucuronide
sc-221604Ezetimibe β-D-Glucuronide

Popular Products