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10-beta Hydroxy Norethindrone

CAT: 1596-AR-N01750-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-N01750-02Size:25 Units
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CAS Number
1236-00-6
Synonyms
(17?) -10,17-Dihydroxy-19-norpregn-4-en-20-yn-3-one; 10,17-Dihydroxy-19-nor-17?-pregn-4-en-20-yn-3-one; 10?,17-Dihydroxy-19-nor-17?-pregn-4-en-20-yn-3-one; 10?,17?-Dihydroxy-17?-ethynylestr-4-en-3-one; 10?-Hydroxy-19-norethisterone; 10?-Hydroxynorethindrone; 10?-Hydroxynorethisterone; 17?-Ethinyl-10?,17?-dihydroxyestr-4-en-3-one; 17?-Ethynyl-10?,17?-dihydroxy-4-estren-3-one; NSC 63012
Molecular Formula
C20H26O3
Molecular Weight
314.43
API Name
Norethindrone

Chemical Information

10beta-Hydroxy-19-norethisterone

17-Ethynyl-10-hydroxy-19-nortestosterone is a 3-hydroxy steroid.

CAS Number1236-00-6
PubChem CID247747
IUPAC Name(8S,9S,10S,13S,14S,17R)-17-ethynyl-10,17-dihydroxy-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Molecular FormulaC20H26O3
Molecular Weight314.4
XLogP1.4
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count23
Formal Charge0
Complexity641
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=O)CC[C@]34O
InChI
InChI=1S/C20H26O3/c1-3-19(22)10-8-16-15-5-4-13-12-14(21)6-11-20(13,23)17(15)7-9-18(16,19)2/h1,12,15-17,22-23H,4-11H2,2H3/t15-,16-,17-,18-,19-,20+/m0/s1
InChIKey
GYRPICHNIDQFOD-RPZLJYRGSA-N
Chemical Structure
2D Structure
2D structure of 10beta-Hydroxy-19-norethisterone
CAS: 1236-00-6
CID: 247747
Formula: C20H26O3
MW: 314.4
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight314.4
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass314.18819469
Monoisotopic Mass314.18819469
Topological Polar Surface Area57.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity641
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