4-Hydroxy testosterone

CAT: 0926-CAA14117-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0926-CAA14117-01Size:25 mg

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CAS Number

2141-17-5

Smiles

CC12CCC3C (C1CCC2O) CCC4=C (C (=O) CCC34C) O

Molecular Formula

C19H28O3

Molecular Weight

304.4 g/mol

Controlled

Yes

Chemical Information

4,17 Beta-dihydroxy-4-androstene-3-one

4-Hydroxytestosterone is a 3-hydroxy steroid. It has a role as an androgen.

CAS Number	2141-17-5
PubChem CID	160615
IUPAC Name	(8R,9S,10R,13S,14S,17S)-4,17-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Molecular Formula	C19H28O3
Molecular Weight	304.4
XLogP	3.2
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	22
Formal Charge	0
Complexity	551

SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C(C(=O)CC[C@]34C)O

InChI

InChI=1S/C19H28O3/c1-18-10-8-15(20)17(22)14(18)4-3-11-12-5-6-16(21)19(12,2)9-7-13(11)18/h11-13,16,21-22H,3-10H2,1-2H3/t11-,12-,13-,16-,18+,19-/m0/s1

InChIKey

BQOIJSIMMIDHMO-FBPKJDBXSA-N

Chemical Structure

2D Structure

CAS: 2141-17-5

CID: 160615

Formula: C19H28O3

MW: 304.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	304.4
XLogP3	3.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	304.20384475
Monoisotopic Mass	304.20384475
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	551
Isotope Atom Count	0
Defined Atom Stereocenter Count	6
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
CAA94487-01	6Alpha-Hydroxy testosterone
KAA39014-01	2Beta-Hydroxy testosterone
NAB16338-01	6Beta-Hydroxy testosterone-d3
EAA22343-01	17Beta-Acetoxy 6beta-hydroxy testosterone
WAA93608-01	2Alpha-Hydroxy testosterone 2,17-diacetate
FH156772-01	Testosterone
EAA03395-01	4,5Alpha-Dihydro-2- (hydroxymethylene) testosterone
FM25693-01	17a-Methyl-4-[ (phenylthio) methyl]testosterone
NBA53999-01	4,17Alpha-Dimethyl-2-hydroxymethylene testosterone
FH66688-01	4-Hydroxy-4'-methoxychalcone