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[3,2-c] Pyrazole-5α-androstan-17β-ol

CAT: 0926-ZDA99665-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0926-ZDA99665-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
99996-65-3
Smiles
[H][C@]12[C@@] ([C@@] (CC[C@@H]3O) ([H]) [C@]3 (C) CC2) ([H]) CC[C@@]4 ([H]) CC5=NNC=C5C[C@@]41C
Molecular Formula
C20H30N2O
Molecular Weight
314.46 g/mol
Controlled
Yes

Chemical Information

17alpha-Demethylated stanozolol
CAS Number99996-65-3
PubChem CID11897297
IUPAC Name(1S,2S,10S,13R,14S,17S,18S)-2,18-dimethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5-dien-17-ol
Molecular FormulaC20H30N2O
Molecular Weight314.5
XLogP4.3
Topological Polar Surface Area48.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count23
Formal Charge0
Complexity496
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@@H]4[C@@]3(CC5=C(C4)NN=C5)C
InChI
InChI=1S/C20H30N2O/c1-19-8-7-16-14(15(19)5-6-18(19)23)4-3-13-9-17-12(11-21-22-17)10-20(13,16)2/h11,13-16,18,23H,3-10H2,1-2H3,(H,21,22)/t13-,14-,15-,16-,18-,19-,20-/m0/s1
InChIKey
GZCJWTCFQKPYQN-YNZDMMAESA-N
Chemical Structure
2D Structure
2D structure of 17alpha-Demethylated stanozolol
CAS: 99996-65-3
CID: 11897297
Formula: C20H30N2O
MW: 314.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight314.5
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass314.235813585
Monoisotopic Mass314.235813585
Topological Polar Surface Area48.9 Ų
Heavy Atom Count23
Formal Charge0
Complexity496
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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