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2Alpha-Hydroxy Testosterone

CAT: 0572-TRC-H956740-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H956740-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
4075-14-3
Synonyms
(2alpha,17beta)-2,17-Dihydroxyandrost-4-en-3-one; 2alpha,17beta-Dihydroxyandrost-4-en-3-one;2alpha,17beta-Dihydroxy-4-androsten-3-one; 2alpha-Hydroxytestosterone;
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)[C@H](O)C[C@]34C)[C@@H]1CC[C@@H]2O
Molecular Formula
C19H28O3
Molecular Weight
304.42
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

(2alpha,17beta)-2,17-Dihydroxyandrost-4-en-3-one

2alpha-hydroxytestosterone is an androstanoid that is testosterone substituted by a alpha-hydroxy group at position 2. A natural product found in Daphnia magna exposed to the biocide tributyltin. It has a role as an androgen and a Daphnia magna metabolite. It is a secondary alpha-hydroxy ketone, a 17beta-hydroxy steroid, a 2alpha-hydroxy steroid, a 3-oxo-Delta(4) steroid and an androstanoid. It is functionally related to a testosterone.

CAS Number4075-14-3
PubChem CID14311666
IUPAC Name(2R,8R,9S,10R,13S,14S,17S)-2,17-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Molecular FormulaC19H28O3
Molecular Weight304.4
XLogP2.8
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count22
Formal Charge0
Complexity539
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)[C@@H](C[C@]34C)O
InChI
InChI=1S/C19H28O3/c1-18-8-7-14-12(13(18)5-6-17(18)22)4-3-11-9-15(20)16(21)10-19(11,14)2/h9,12-14,16-17,21-22H,3-8,10H2,1-2H3/t12-,13-,14-,16+,17-,18-,19-/m0/s1
InChIKey
ZOIPFFUVGMVQGE-DTQPDNRZSA-N
Chemical Structure
2D Structure
2D structure of (2alpha,17beta)-2,17-Dihydroxyandrost-4-en-3-one
CAS: 4075-14-3
CID: 14311666
Formula: C19H28O3
MW: 304.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight304.4
XLogP32.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass304.20384475
Monoisotopic Mass304.20384475
Topological Polar Surface Area57.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity539
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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