3-Deoxyvitamin D3
Grundinformationen
- CAS
69662-75-5- Standard-SMILES
C=C1CCCC/C1=C/C=C1\CCC[C@]2(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@@H]12- InChIKey
FXKMDILIEQILCA-VDVRBEGSSA-N- Summenformel
- C27H44
- Durchschnittliche Molmasse
- 368,6 g/mol
Überblick
(5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene is a vitamin D.
Namen und Bezeichner
- Bevorzugter Name
- 3-Deoxyvitamin D3
- IUPAC
- (1R,3aS,4E,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-4-[(2Z)-2-(2-methylidenecyclohexylidene)ethylidene]-2,3,3a,5,6,7-hexahydro-1H-indene
- Englischer Name
- 3-Desoxyvitamin D3
- Summenformel
- C27H44
- Molmasse
- 368.64
Namen und Synonyme
3-Deoxyvitamin D3(5Z,7E)-9,10-seco-5,7,10(19)-cholestatrieneRefChem:93698orb3023841SCHEMBL4993254SCHEMBL20581610CHEBI:13713969662-75-5LMST03020618TN11080(1R,3aS,4E,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-4-[(2Z)-2-(2-methylidenecyclohexylidene)ethylidene]-2,3,3a,5,6,7-hexahydro-1H-indene3-Desoxyvitamin D3
Weitere Namen anzeigen
3-deoxy Vitamin D33-Desoxyvitamin D3 (~90%)(1R,3aS,7aR,E)-7a-methyl-4-((Z)-2-(2-methylenecyclohexylidene)ethylidene)-1-((R)-6-methylheptan-2-yl)octahydro-1H-indene1H-Indene, 1-[(1R)-1,5-dimethylhexyl]octahydro-7a-methyl-4-[(2Z)-2-(2-methylenecyclohexylidene)ethylidene]-, (1R,3aS,4E,7aR)-
Datenbank-Bezeichner
- CAS
69662-75-5
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 9,3
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 0
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 27
- Formalladung
- 0
- Komplexität
- 575
Experimentelle und physikochemische Eigenschaften
LipidsLipids -> Sterol Lipids [ST] -> Secosteroids [ST03] -> Vitamin D3 and derivatives [ST0302]
Physikochemische Eigenschaften
- Siedepunkt
- 463.3 · 463.3±12.0 °C(Predicted)
- Dichte
- 0.92 · 0.92±0.1 g/cm3(Predicted)
- storage temp.
- -86 °C · Amber Vial, -86°C Freezer, Under inert atmosphere
- Löslichkeit
- Acetonitrile (Slightly), Chloroform (Slightly)
- Aggregatzustand
- Solid
- Farbe
- White to Off-White
- Stabilität
- Light Sensitive, Temperature Sensitive
Chemie und Industrie
Anwendungen
Verwenden3-Desoxyvitamin D3 is a derivative of Vitamin D3 (V676045), the vitamin that mediates intestinal calcium absorbtion, bone calcium metabolism and probably, muscle activity. It occurs in and is isolated from fish liver oils. Vitamin D acts through a receptor that is a member of the ligand-dependent transcription factor superfamily. It modulates the proliferation and differentiation of both normal and cancer cells. It also has antiproliferative and antimetastatic effects on breast, colon, and prostate cancer cells. Activated vitamin D receptors in intestine and bone maintain calcium absorbance and homeostasis.
Anbieter6 Anbieter
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
北京康派森医药科技有限公司010-010-52878169 15801002657 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
雷丁科技0510-85629785 18013409632 · [email protected]
Zugehörige Reaktionen
0
Keine Reaktionsaufzeichnungen unter den aktuellen Filterkriterien.
Notizen zur Verbindung
Wird geladen…