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Moxestrol

CAT: 0013-GTR19198854-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198854-01Size:50 mg
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Description
Moxestrol is a synthetic estrogen receptor agonist historically used in Europe to manage menopausal symptoms and menstrual disorders. It serves as a research tool for studying estrogen signaling in both in vitro and in vivo models related to endocrinology and reproductive biology.
CAS Number
34816-55-2
Field of Research
Pharmacology & Drug Discovery
Smiles
O (C) [C@@H]1[C@]2 ([C@] ([C@]3 ([C@] (C) (C1) [C@@] (C#C) (O) CC3) [H]) (CCC=4C2=CC=C (O) C4) [H]) [H]
Molecular Formula
C21H26O3
Molecular Weight
326.43
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Moxestrol

Moxestrol is a 3-hydroxy steroid.

CAS Number34816-55-2
PubChem CID11954041
IUPAC Name(8S,9S,11S,13S,14S,17R)-17-ethynyl-11-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
Molecular FormulaC21H26O3
Molecular Weight326.4
XLogP3
Topological Polar Surface Area49.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity551
SMILES
C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O)OC
InChI
InChI=1S/C21H26O3/c1-4-21(23)10-9-17-16-7-5-13-11-14(22)6-8-15(13)19(16)18(24-3)12-20(17,21)2/h1,6,8,11,16-19,22-23H,5,7,9-10,12H2,2-3H3/t16-,17-,18-,19+,20-,21-/m0/s1
InChIKey
MTMZZIPTQITGCY-OLGWUGKESA-N
Chemical Structure
2D Structure
2D structure of Moxestrol
CAS: 34816-55-2
CID: 11954041
Formula: C21H26O3
MW: 326.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight326.4
XLogP33
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass326.18819469
Monoisotopic Mass326.18819469
Topological Polar Surface Area49.7 Ų
Heavy Atom Count24
Formal Charge0
Complexity551
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T25834-01Moxestrol

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