Products for Research Use Only
RegisterLogin

Ciclopirox beta-D-Glucuronide

CAT: 0024-sc-207433Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0024-sc-207433Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
79419-54-8

Chemical Information

Ciclopirox beta-D-Glucuronide
CAS Number79419-54-8
PubChem CID46781024
IUPAC Name(3R,6R)-6-[(2-cyclohexyl-4-methyl-6-oxo-1-pyridinyl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular FormulaC18H25NO8
Molecular Weight383.4
XLogP0.6
Topological Polar Surface Area137
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity654
SMILES
CC1=CC(=O)N(C(=C1)C2CCCCC2)O[C@@H]3C(C([C@H](C(O3)C(=O)O)O)O)O
InChI
InChI=1S/C18H25NO8/c1-9-7-11(10-5-3-2-4-6-10)19(12(20)8-9)27-18-15(23)13(21)14(22)16(26-18)17(24)25/h7-8,10,13-16,18,21-23H,2-6H2,1H3,(H,24,25)/t13?,14-,15?,16?,18-/m1/s1
InChIKey
RRBPTSPRUYTJLL-OIJGMWSASA-N
Chemical Structure
2D Structure
2D structure of Ciclopirox beta-D-Glucuronide
CAS: 79419-54-8
CID: 46781024
Formula: C18H25NO8
MW: 383.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight383.4
XLogP30.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass383.15801676
Monoisotopic Mass383.15801676
Topological Polar Surface Area137 Ų
Heavy Atom Count27
Formal Charge0
Complexity654
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
sc-217895Ciclopirox-d11 β-D-Glucuronide Lithium Salt
sc-217893Ciclopirox
sc-218000D- (-) -Norgestrel β-D-Glucuronide
sc-257613Indoxyl beta-D-glucuronide CHA salt, IBDG
sc-204688ACiclopirox Olamine
sc-204688Ciclopirox Olamine
sc-217894Ciclopirox-d11
sc-212916Scopoletin β-D-Glucuronide
sc-498152Fluconazole β-D-Glucuronide
sc-213104Trichloroethyl β-D-Glucuronide

Alternative Products

CatalogName
TRC-C432810-10MGCiclopirox Beta-D-Glucuronide
TRC-C432812-1MGCiclopirox-d11 beta-D-Glucuronide
292896-01Ciclopirox D-glucuronide
HY-132480S-01Ciclopirox-d11 β-D-Glucuronide
MC09480-01Ciclopirox D-glucuronide sodium salt
AR-C02752-01Ciclopirox Glucuronide
AR-C02754-01Ciclopirox-d11 Glucuronide
AR-C07521-01Ciclopirox Glucuronide Lithium Salt
AR-C07522-01Ciclopirox Glucuronide-d11 Lithium Salt
TRC-N689515-10MGD-(-)-Norgestrel Beta-D-Glucuronide

Popular Products