Products for Research Use Only
RegisterLogin

7-Hydroxy coumarin glucuronide (sodium)

CAT: 0804-HY-120201-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-120201-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
7-Hydroxy coumarin glucuronide sodium is a benzopyrone and a metabolite of 7-hydroxy coumarin[1].
CAS Number
168286-98-4
UNSPSC
12352005
Hazard Statement
H302+H312+H332
Target
Drug Metabolite
Related Pathways
Metabolic Enzyme/Protease
Field of Research
Others
Smiles
O=C1C=CC2=CC=C(C=C2O1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(O[Na])=O)O)O)O
Molecular Formula
C15H13NaO9
Molecular Weight
360.25
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501
References & Citations
[1]Negoro R, et al. Generation of HepG2 Cells with High Expression of Multiple Drug-Metabolizing Enzymes for Drug Discovery Research Using a PITCh System. Cells. 2022 May 18;11 (10) :1677.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

7-Hydroxycoumarin glucuronide sodium salt
CAS Number168286-98-4
PubChem CID23675380
IUPAC Namesodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-oxochromen-7-yl)oxyoxane-2-carboxylate
Molecular FormulaC15H13NaO9
Molecular Weight360.25
Topological Polar Surface Area146
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity539
SMILES
C1=CC(=CC2=C1C=CC(=O)O2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)[O-])O)O)O.[Na+]
InChI
InChI=1S/C15H14O9.Na/c16-9-4-2-6-1-3-7(5-8(6)23-9)22-15-12(19)10(17)11(18)13(24-15)14(20)21;/h1-5,10-13,15,17-19H,(H,20,21);/q;+1/p-1/t10-,11-,12+,13-,15+;/m0./s1
InChIKey
SKHLGBDGEPDEME-KSOKONAESA-M
Chemical Structure
2D Structure
2D structure of 7-Hydroxycoumarin glucuronide sodium salt
CAS: 168286-98-4
CID: 23675380
Formula: C15H13NaO9
MW: 360.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight360.25
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Exact Mass360.04572627
Monoisotopic Mass360.04572627
Topological Polar Surface Area146 Ų
Heavy Atom Count25
Formal Charge0
Complexity539
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-W7661637-Hydroxy coumarin glucuronide-d5 (sodium)
HY-120201S7-Hydroxy Coumarin-d5 β-D-glucuronide (sodium)
HY-1299777-Hydroxy coumarin sulfate (potassium)
HY-W744217-017-Hydroxy coumarin sulfate-d5 (potassium)
HY-125750-01Coumarin 7
HY-W3941666-Bromo-7-hydroxy-4- (hydroxymethyl) coumarin
HY-W766140-014-Hydroxy duloxetine β-D-glucuronide (sodium)
HY-N101677- (6'R-Hydroxy-3',7'-dimethylocta-2',7'-dienyloxy) coumarin
HY-114541-01Coumarin-7-pinacolboronate
HY-135245-01Ezetimibe hydroxy glucuronide

Alternative Products

CatalogName
AR-C03666-017-Hydroxy Coumarin Glucuronide Sodium
GTR19190683-017-hydroxy Coumarin Glucuronide (sodium salt)
sc-210617C7-Hydroxy Coumarin β-D-Glucuronide Sodium Salt
AR-C08403-017-Hydroxy Coumarin-d5 Glucuronide Sodium Salt
TRC-H924880-10MG7-Hydroxy Coumarin Beta-D-Glucuronide Sodium Salt
sc-2174457-Hydroxy Coumarin-d5 β-D-Glucuronide Sodium Salt
TRC-H924882-10MG7-Hydroxy Coumarin-d5 Beta-D-Glucuronide Sodium Salt
sc-2174437-Hydroxy Coumarin-13C6 β-D-Glucuronide
AR-C03674-017-Hydroxy-4-Methyl Coumarin Glucuronide
TRC-H924883-1MG7-Hydroxy Coumarin-13C6 Beta-D-Glucuronide Sodium Salt

Popular Products