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Promegestone

CAT: 0013-GTR19193041-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19193041-01Size:25 mg
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Description
Promegestone is a synthetic progestin employed in research related to menopausal hormone therapy and gynecological disorders. It is utilized in both in vitro and in vivo studies to investigate progesterone receptor-mediated mechanisms and endocrine function.
CAS Number
34184-77-5
Field of Research
Pharmacology & Drug Discovery
Smiles
C[C@@]12[C@] ([C@]3 (C (CC1) =C4C (CC3) =CC (=O) CC4) [H]) (CC[C@@]2 (C (CC) =O) C) [H]
Molecular Formula
C22H30O2
Molecular Weight
326.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Promegestone

Promegestone is a progestin consisting of 17beta-propionylestra-4,9-dien-3-one substituted at position 17 by a methyl group. It has a role as an antineoplastic agent, a progestin and a progesterone receptor agonist. It is a 20-oxo steroid and a 3-oxo-Delta(4) steroid. It derives from a hydride of an estrane.

CAS Number34184-77-5
PubChem CID36709
IUPAC Name(8S,13S,14S,17S)-13,17-dimethyl-17-propanoyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Molecular FormulaC22H30O2
Molecular Weight326.5
XLogP3.3
Topological Polar Surface Area34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity667
SMILES
CCC(=O)[C@]1(CC[C@@H]2[C@@]1(CCC3=C4CCC(=O)C=C4CC[C@@H]23)C)C
InChI
InChI=1S/C22H30O2/c1-4-20(24)22(3)12-10-19-18-7-5-14-13-15(23)6-8-16(14)17(18)9-11-21(19,22)2/h13,18-19H,4-12H2,1-3H3/t18-,19+,21+,22-/m1/s1
InChIKey
QFFCYTLOTYIJMR-XMGTWHOFSA-N
Chemical Structure
2D Structure
2D structure of Promegestone
CAS: 34184-77-5
CID: 36709
Formula: C22H30O2
MW: 326.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight326.5
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass326.224580195
Monoisotopic Mass326.224580195
Topological Polar Surface Area34.1 Ų
Heavy Atom Count24
Formal Charge0
Complexity667
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
MBS5783665Promegestone

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