Oleoylestrone
Grundinformationen
- CAS
180003-17-2- Standard-SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12- InChIKey
IMIPDPVHGGHVNH-YWVHRCQQSA-N- Summenformel
- C36H54O3
- Durchschnittliche Molmasse
- 534,8 g/mol
- Monoisotopische Masse
- 534,40729558
Überblick
Oleoyl-estrone (OE) is a fatty acid ester of estrone. This hormone occurs naturally and is found circulating in various animal species and humans. It has been shown in animal studies to promote the loss of body fat while maintaining body protein storage, maintaining nitrogen balance. Body protein loss is an unpleasant effect of fat loss by the restriction of calories, and studies show that this drug appears to avoid this effect.
Namen und Bezeichner
- Bevorzugter Name
- Oleoylestrone
- IUPAC
- [(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] (Z)-octadec-9-enoate
- Englischer Name
- 3-Oleoylestrone-2,4,16,16-D4
- Summenformel
- C36H54O3
- Molmasse
- 534.81
Namen und Synonyme
oleoylestroneOleoyl-estroneEstrone 3-oleate180003-17-2oleoyl estroneestrone monooleateEstrone oleic acid ester64R56KMG1ZMP-101 (OLEOYLESTRONE)DTXSID8041086Estra-1,3,5(10)-trien-17-one, 3-(((9Z)-1-oxo-9-octadecen-1-yl)oxy)-[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] (Z)-octadec-9-enoate
Weitere Namen anzeigen
MP101MP-101MP 101[3(Z)]-3-[(1-Oxo-9-octadecenyl)oxy]estra-1,3,5(10)-trien-17-oneEstra-1,3,5(10)-trien-17-one, 3-[[(9Z)-1-oxo-9-octadecen-1-yl]oxy]-(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl oleate
((8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta(a)phenanthren-3-yl) (Z)-octadec-9-enoateRefChem:168100DTXCID6021086(1S,10R,11S,15S)-15-methyl-14-oxotetracyclo(8.7.0.02,?.011,1?)heptadeca-2(7),3,5-trien-5-yl (9Z)-octadec-9-enoateMerlin-2UNII-64R56KMG1ZOleoyl-estrone (mp 101)SCHEMBL38079
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 10,7
- Polarare Oberfläche (TPSA)
- 43,4 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 17
- Schwere Atome
- 39
- Formalladung
- 0
- Komplexität
- 786
Experimentelle und physikochemische Eigenschaften
DrugsPharmaceuticals -> Listed in ZINC15
Physikochemische Eigenschaften
- Siedepunkt
- 644.2 · 644.2±55.0 °C(Predicted)
- Dichte
- 1.01 · 1.010
Chemie und Industrie
Pharmakologische Informationen
PharmacodynamicsOleoyl-estrone is a fatty acid ester of estrone, and may be directly involved in the control of body weight (PMID: 8782737).
Mechanism of Action
Based on extensive preclinical studies, it is believed that oleoyl-estrone (OE) works by a dual mechanism of action. Centrally, OE appears to act at the brain's hypothalamus, resetting the body's ponderostat, the “food control center” in the brain that detects and integrates signals that control both appetite and metabolic behavior. Peripherally, OE also causes reduced storage of fat in “white fat” tissue and allows skeletal muscle to use fat as an alternate energy source.
MeSH Pharmacological ClassificationAgents that increase energy expenditure and weight loss by neural and metabolic regulation.
Absorption, Distribution and ExcretionOrally available
Anbieter8 Anbieter
盐城通铭生物科技有限公司15195160625 · [email protected]
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上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
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TargetMol中国（陶术生物）15002134094 · [email protected]
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