Tìm theo
APL-202
Thuốc Gốc
Small Molecule
CTHH: C22H38O5
PTK: 382.5341
APL-202 is currently licensed in the UK for the treatment of peptic ulcers but has also been widely used off label in obstetrics including cervical ripening and induction of labour.
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C22H38O5
Phân tử khối
382.5341
Monoisotopic mass
382.271924326
InChI
InChI=1S/C22H38O5/c1-4-5-14-22(2,26)15-10-12-18-17(19(23)16-20(18)24)11-8-6-7-9-13-21(25)27-3/h10,12,17-18,20,24,26H,4-9,11,13-16H2,1-3H3/b12-10+/t17-,18-,20-,22?/m1/s1
InChI Key
InChIKey=OJLOPKGSLYJEMD-URPKTTJQSA-N
IUPAC Name
methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(1E)-4-hydroxy-4-methyloct-1-en-1-yl]-5-oxocyclopentyl]heptanoate
Traditional IUPAC Name
misoprostol
SMILES
CCCCC(C)(O)C\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC
Độ hòa tan
1.64e-02 g/l
logP
3.86
logS
-4.4
pKa (strongest acidic)
14.68
pKa (Strongest Basic)
-0.95
PSA
83.83 Å2
Refractivity
107.88 m3·mol-1
Polarizability
45.38 Å3
Rotatable Bond Count
14
H Bond Acceptor Count
4
H Bond Donor Count
2
Physiological Charge
0
Number of Rings
1
Bioavailability
1
Rule of Five
true
Ghose Filter
true
Cơ Chế Tác Dụng : APL-202 is currently licensed in the UK for the treatment of peptic ulcers but has also been widely used off label in obstetrics including cervical ripening and induction of labour. Prostaglandins are naturally occurring fatty acids produced by many tissues in the body. Prostaglandin E1 causes myometrial contractions by interacting with specific receptors on myometrial cells. This interaction results in a cascade of events, including a change in calcium concentration, thereby initiating muscle contraction. Misoprostol is an analog of prostaglandin E1. By interacting with prostaglandin receptors, misoprostol causes the cervix to soften and the uterus to contract, resulting in the expulsion of the uterine contents. Misoprostol is relatively metabolically resistant, and thus has prolonged action.
Chỉ Định : Investigated for use/treatment in labor and delivery.
Dữ Kiện Thương Mại
Nhà Sản Xuất
  • Công ty :
    Sản phẩm biệt dược : Isprelor
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB05379
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=5282381
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=12013227
ChemSpider
http://www.chemspider.com/Chemical-Structure.4445541.html
Wikipedia
http://en.wikipedia.org/wiki/Misoprostol
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