Products for Research Use Only
RegisterLogin

N-Dealkylated-mPEG7-Naloxol

CAT: 0013-GTR19281184-01Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19281184-01Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
N-Dealkylated-mPEG7-Naloxol is a metabolite of Naloxegol.
CAS Number
2194602-13-4
Smiles
O[C@]12[C@@]34C=5C (O[C@]3 ([C@@H] (OCCOCCOCCOCCOCCOCCOCCOC) CC1) [H]) =C (O) C=CC5C[C@]2 (NCC4) [H]
Molecular Formula
C31H49NO11
Molecular Weight
611.73
Notes
For research use only.

Chemical Information

Naloxone Impurity 39
CAS Number2194602-13-4
PubChem CID178245135
IUPAC Name(4R,4aS,7S,7aR,12bS)-7-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2,3,4,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol
Molecular FormulaC31H49NO11
Molecular Weight611.7
XLogP-2.1
Topological Polar Surface Area136
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count12
Rotatable Bond Count22
Heavy Atom Count43
Formal Charge0
Complexity810
SMILES
COCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@]2([C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3)O
InChI
InChI=1S/C31H49NO11/c1-35-8-9-36-10-11-37-12-13-38-14-15-39-16-17-40-18-19-41-20-21-42-25-4-5-31(34)26-22-23-2-3-24(33)28-27(23)30(31,6-7-32-26)29(25)43-28/h2-3,25-26,29,32-34H,4-22H2,1H3/t25-,26+,29-,30-,31+/m0/s1
InChIKey
VCRSJVHUIZTPPO-XPLSERNMSA-N
Chemical Structure
2D Structure
2D structure of Naloxone Impurity 39
CAS: 2194602-13-4
CID: 178245135
Formula: C31H49NO11
MW: 611.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight611.7
XLogP3-2.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count12
Rotatable Bond Count22
Exact Mass611.33056138
Monoisotopic Mass611.33056138
Topological Polar Surface Area136 Ų
Heavy Atom Count43
Formal Charge0
Complexity810
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

Related Products

CatalogName
GTR19229829-016-Alpha Naloxol
GTR19075396-01Recombinant Human MPEG1 Protein, N-His
GTR19140231-01Recombinant Human MPEG1 Protein, N-His
GTR19119818-01Recombinant Human MPEG1 Protein, N-His
GTR19246649-01N, N, N′, N′-Tetramethylethylenediamine
GTR19244870-01N, N, N', N'-Tetramethylchloroformamidinium hexafluorophosphate
GTR19257502-01N, N', N''-Triacetylchitotriose
GTR19223622-01Deacylated alfuzosin
GTR19227040-01Naloxon
GTR19244933-01N, N, N-Trimethylethanaminium iodide

Alternative Products

CatalogName
HY-404346N-Dealkylated-mPEG7-Naloxol
MD001002-7-01mPEG7-OH
MD001003-7mPEG7-SH
516897MPEG7-Br
MD001007-7MPEG7-Alkyne
MD001176-7-01mPEG7-MS
MD001005-7-01mPEG7-NH2
TRC-N284495-10MG6a-Naloxol
FM72945-01MPEG7-NHS
MD001121-7MPEG7-CH2COOH

Popular Products