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Dimethandrolone undecanoate

CAT: 0804-HY-164032-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-164032-01Size:1 mg
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Description
Dimethandrolone undecanoate (7α,11β-Dimethyl-17β-hydroxyestr-4-en-3-one 17-undecanoate) exhibits withrogens and progesterone activity. Dimethandrolone undecanoate inhibits production of gonadotropins, suppresses testosterone production, and thus inhibits sperm production. Dimethandrolone undecanoate is potent for development of male hormone contraceptives[1].
CAS Number
366472-45-9
Product Name Alternative
7α,11β-Dimethyl-17β-hydroxyestr-4-en-3-one 17-undecanoate
UNSPSC
12352211
Target
GnRH Receptor
Type
Reference compound
Related Pathways
GPCR/G Protein
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Endocrinology
Assay Protocol
https://www.medchemexpress.com/dimethandrolone-undecanoate.html
Smiles
C[C@@]12[C@](CC[C@@H]2OC(CCCCCCCCCC)=O)([H])[C@@]3([H])[C@@]([C@H](C1)C)([H])[C@]4([H])C(C[C@H]3C)=CC(CC4)=O
Molecular Formula
C31H50O3
Molecular Weight
470.73
References & Citations
[1]Yuen F, et al., Comparison of metabolic effects of the progestational androgens dimethandrolone undecanoate and 11β-MNTDC in healthy men. Andrology. 2021 Sep;9 (5) :1526-1539.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Dimethandrolone Undecanoate

Dimethandrolone Undecanoate is under investigation in clinical trial NCT03455075 (Study of Spermatogenesis Suppression With DMAU Alone or With LNG Versus Placebo Alone in Normal Men).

CAS Number366472-45-9
PubChem CID67333747
IUPAC Name[(7R,8R,9S,10R,11S,13S,14S,17S)-7,11,13-trimethyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] undecanoate
Molecular FormulaC31H50O3
Molecular Weight470.7
XLogP8.5
Topological Polar Surface Area43.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count11
Heavy Atom Count34
Formal Charge0
Complexity754
SMILES
CCCCCCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2[C@@H](CC4=CC(=O)CC[C@H]34)C)C)C
InChI
InChI=1S/C31H50O3/c1-5-6-7-8-9-10-11-12-13-28(33)34-27-17-16-26-30-21(2)18-23-19-24(32)14-15-25(23)29(30)22(3)20-31(26,27)4/h19,21-22,25-27,29-30H,5-18,20H2,1-4H3/t21-,22+,25+,26+,27+,29-,30+,31+/m1/s1
InChIKey
FVICENFBEMJOCE-RTFNQGFNSA-N
Chemical Structure
2D Structure
2D structure of Dimethandrolone Undecanoate
CAS: 366472-45-9
CID: 67333747
Formula: C31H50O3
MW: 470.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight470.7
XLogP38.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count11
Exact Mass470.37599545
Monoisotopic Mass470.37599545
Topological Polar Surface Area43.4 Ų
Heavy Atom Count34
Formal Charge0
Complexity754
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

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