Cholest-4-en-3-one
Grundinformationen
- CAS
72560-60-2- Standard-SMILES
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C- InChIKey
NYOXRYYXRWJDKP-GYKMGIIDSA-N- Summenformel
- C27H44O
- Durchschnittliche Molmasse
- 384,6 g/mol
Überblick
Cholest-4-en-3-one is a cholestanoid that is cholest-4-ene substituted by an oxo group at position 3. It has a role as a plant metabolite and a human metabolite. It is a 3-oxo-Delta(4) steroid and a cholestanoid.
Namen und Bezeichner
- Bevorzugter Name
- Cholest-4-en-3-one
- IUPAC
- (8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
- Englischer Name
- 4-Cholesten-3-one-2,2,4,6,6-d5
- Summenformel
- C27H44O
- Molmasse
- 384.65
Namen und Synonyme
4-Cholesten-3-one601-57-0Cholestenonecholest-4-en-3-one3-Oxocholest-4-ene7T94NHD99CDTXSID90872379CHEBI:16175NSC-63000NSC-134926(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((2R)-6-methylheptan-2-yl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta(a)phenanthren-3-one
Weitere Namen anzeigen
4-Cholesten-3-one-2,2,4,6,6(Cholestenone-2,2,4,6,6-D5)4-Cholesten-3-one-2,2,4,6,6-d5Cholestenone (2,2,4,6,6-D?, 98%)4-Cholesten-3-One-2,2,4,6,6-D5 (Standard)
RefChem:576025DTXCID40820027210-005-1Cholesterone(+)-4-Cholesten-3-one3-Oxo-4-cholestene3-Keto-4-cholestenedelta(sup 4)-Cholestenone
Datenbank-Bezeichner
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 8,4
- Polarare Oberfläche (TPSA)
- 17,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 28
- Formalladung
- 0
- Komplexität
- 630
Experimentelle und physikochemische Eigenschaften
LipidsLipids -> Sterol Lipids [ST] -> Sterols [ST01] -> Cholesterol and derivatives [ST0101]
SpringerMaterials PropertiesCrystal structure
Melting Point79 - 82 °C
Physical DescriptionSolid
Physikochemische Eigenschaften
- Schmelzpunkt
- 80 · 80-82°C
- storage temp.
- -20 °C · -20°C Freezer
- Löslichkeit
- Chloroform (Slightly), Ethyl Acetate (Slightly). Methanol (Slightly)
- Aggregatzustand
- Solid
- Farbe
- White to Off-White
- CAS Number Unlabeled
- 601 · 601-57-0
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
H413 (95%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesAquatic Chronic 4 (95%)
Chemie und Industrie
Pharmakologische Informationen
Tissue LocationsGall Bladder
Cellular LocationsExtracellular
Verwendung und Herstellung
General Manufacturing InformationCholest-4-en-3-one: ACTIVE
Anwendungen
Verwenden4-Cholesten-3-one-2,2,4,6,6-d5 is the labelled version of Δ4-Cholesten-3-one (C432100(P)), which is an intestinal metabolite of Cholesterol (C432501(P)) with anti-obesity effect on animals.
Anbieter10 Anbieter
盐城通铭生物科技有限公司15195160625 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
热耳科技（上海）有限公司021-64400900 15800436310 · [email protected]
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