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Testosterone Decanoate

CAT: 1299-RM-T691518-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-T691518-01Size:10 mg
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CAS Number
5721-91-5
Synonyms
(8R,9S,10R,13S,14S,17S) -10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl decanoate
Molecular Formula
C29H46O3
Molecular Weight
442.67
Target Alternative Name
Testosterone
Product Name Synonym
(8R,9S,10R,13S,14S,17S) -10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl decanoate

Chemical Information

Testosterone decanoate

Testosterone decanoate is a steroid ester.

CAS Number5721-91-5
PubChem CID155143
IUPAC Name[(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] decanoate
Molecular FormulaC29H46O3
Molecular Weight442.7
XLogP8
Topological Polar Surface Area43.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Heavy Atom Count32
Formal Charge0
Complexity724
SMILES
CCCCCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C
InChI
InChI=1S/C29H46O3/c1-4-5-6-7-8-9-10-11-27(31)32-26-15-14-24-23-13-12-21-20-22(30)16-18-28(21,2)25(23)17-19-29(24,26)3/h20,23-26H,4-19H2,1-3H3/t23-,24-,25-,26-,28-,29-/m0/s1
InChIKey
LBERVHLCXUMDOT-MPZZESAYSA-N
Chemical Structure
2D Structure
2D structure of Testosterone decanoate
CAS: 5721-91-5
CID: 155143
Formula: C29H46O3
MW: 442.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight442.7
XLogP38
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Exact Mass442.34469533
Monoisotopic Mass442.34469533
Topological Polar Surface Area43.4 Ų
Heavy Atom Count32
Formal Charge0
Complexity724
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