Tìm theo
5-Androstenediol
Thuốc Gốc
Small Molecule
CTHH: C19H30O2
PTK: 290.4403
An intermediate in testosterone biosynthesis, found in the testis or the adrenal glands. Androstenediol, derived from dehydroepiandrosterone by the reduction of the 17-keto group (17-hydroxysteroid dehydrogenases), is converted to testosterone by the oxidation of the 3-beta hydroxyl group to a 3-keto group (3-hydroxysteroid dehydrogenases). [PubChem]
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C19H30O2
Phân tử khối
290.4403
Monoisotopic mass
290.224580204
InChI
InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-17,20-21H,4-11H2,1-2H3
InChI Key
InChIKey=QADHLRWLCPCEKT-UHFFFAOYSA-N
IUPAC Name
2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-ene-5,14-diol
Traditional IUPAC Name
androstenediol
SMILES
CC12CCC3C(CC=C4CC(O)CCC34C)C1CCC2O
Độ hòa tan
5.50e-02 g/l
logP
2.8
logS
-3.7
pKa (strongest acidic)
18.2
pKa (Strongest Basic)
-0.77
PSA
40.46 Å2
Refractivity
85.48 m3·mol-1
Polarizability
34.73 Å3
Rotatable Bond Count
0
H Bond Acceptor Count
2
H Bond Donor Count
2
Physiological Charge
0
Number of Rings
4
Bioavailability
1
Rule of Five
true
Ghose Filter
true
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB01524
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=223407
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46507476
ChemSpider
http://www.chemspider.com/Chemical-Structure.194034.html
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