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Norgestrienone

CAT: 0013-GTR19193309-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19193309-03Size:50 mg
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Description
Nogotrienone is a synthetic anabolic steroid investigated for its dual fertility-regulating and contraceptive effects. Research has explored its therapeutic potential, notably in the treatment of hereditary angioedema, through both in vitro assays and in vivo experimental models.
CAS Number
848-21-5
Field of Research
Pharmacology & Drug Discovery
Smiles
[H][C@@]12CC[C@@] (O) (C#C) [C@@]1 (C) C=CC1=C3CCC (=O) C=C3CC[C@@]21[H]
Molecular Formula
C20H22O2
Molecular Weight
294.39
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Norgestrienone

Norgestrienone is a steroid. It has a role as an estrogen.

CAS Number848-21-5
PubChem CID13313
IUPAC Name(8S,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Molecular FormulaC20H22O2
Molecular Weight294.4
XLogP1.8
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count22
Formal Charge0
Complexity698
SMILES
C[C@]12C=CC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@]2(C#C)O
InChI
InChI=1S/C20H22O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,8,10,12,17-18,22H,4-7,9,11H2,2H3/t17-,18+,19+,20+/m1/s1
InChIKey
GVDMJXQHPUYPHP-FYQPLNBISA-N
Chemical Structure
2D Structure
2D structure of Norgestrienone
CAS: 848-21-5
CID: 13313
Formula: C20H22O2
MW: 294.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight294.4
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass294.161979940
Monoisotopic Mass294.161979940
Topological Polar Surface Area37.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity698
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-111302Norgestrienone

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