Melengestrol
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Grundinformationen
- CAS
5633-18-1- Standard-SMILES
C=C1C[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@@]1(O)C(C)=O- InChIKey
OKHAOBQKCCIRLO-IBVJIVQJSA-N- Summenformel
- C23H30O3
- Durchschnittliche Molmasse
- 354,5 g/mol
- Monoisotopische Masse
- 354,21949481
Überblick
Melengestrol is a steroidal progestin and antineoplastic agent which was never marketed. An acylated derivative, melengestrol acetate, is used as a growth promoter in animals.
Namen und Bezeichner
- Bevorzugter Name
- Melengestrol
- IUPAC
- (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-16-methylidene-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
- Lokaler Name
- Melengestrol
- Englischer Name
- melengestrol
- Summenformel
- C23H30O3
- Molmasse
- 354.48
Namen und Synonyme
Melengestrol5633-18-1MelengesterolMelengestrelMelengestroloMelengestrolumBX98J4T6JU17-Hydroxy-6-methyl-16-methylenepregna-4,6-diene-3,20-dioneDTXSID00204869RefChem:156330DTXCID80127360(1S,2R,10R,11S,14R,15S)-14-acetyl-14-hydroxy-2,8,15-trimethyl-13-methylidenetetracyclo(8.7.0.02,?.011,1?)heptadeca-6,8-dien-5-one
Weitere Namen anzeigen
melengestrol solution,100ppmMelengestrol Acetate Impurity 3Pregna-4,6-diene-3,20-dione, 17-hydroxy-6-methyl-16-methylene-(17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-16-methylene-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one(17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-16-methylidene-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one(17R)-17-ethanoyl-17-hydroxy-6,10,13-trimethyl-16-methylidene-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
227-073-3(8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-16-methylidene-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one(8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-16-methylene-1,2,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-oneMelengestrel; MelengestrolMelengestrolo [DCIT]Melengestrol [INN:BAN]UNII-BX98J4T6JUMelengestrolum [INN-Latin]
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 2,5
- Polarare Oberfläche (TPSA)
- 54,4 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 26
- Formalladung
- 0
- Komplexität
- 787
Experimentelle und physikochemische Eigenschaften
Endocrine DisruptorsPotential endocrine disrupting compound
Physikochemische Eigenschaften
- Siedepunkt
- 512.4 · 512.4±50.0 °C(Predicted)
- Dichte
- 1.15 · 1.15
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- pka
- 12.25 · 12.25±0.70(Predicted)
- Farbe
- Off-White to Yellow
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H361fd (100%): Suspected of damaging fertility; Suspected of damaging the unborn child [Warning Reproductive toxicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesRepr. 2 (100%)
Chemie und Industrie
Pharmakologische Informationen
ATC CodeQG - Genito urinary system and sex hormones
MeSH Pharmacological Classification
A group of CORTICOSTEROIDS that affect carbohydrate metabolism (GLUCONEOGENESIS, liver glycogen deposition, elevation of BLOOD SUGAR), inhibit ADRENOCORTICOTROPIC HORMONE secretion, and possess pronounced anti-inflammatory activity. They also play a role in fat and protein metabolism, maintenance of arterial blood pressure, alteration of the connective tissue response to injury, reduction in the number of circulating lymphocytes, and functioning of the central nervous system.
Anwendungen
VerwendenMelengestrol Acetate derivative, an orally active progestational steroid.
Zugehörige Reaktionen
1
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