Tìm theo
Lanosterol
Thuốc Gốc
Small Molecule
CAS: 79-63-0
CTHH: C30H50O
PTK: 426.7174
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
426.7174
Monoisotopic mass
426.386166222
InChI
InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,21-22,25-26,31H,9,11-19H2,1-8H3/t21-,22-,25+,26+,28-,29+,30+/m0/s1
InChI Key
InChIKey=CAHGCLMLTWQZNJ-RGEKOYMOSA-N
IUPAC Name
(2R,5R,7S,11S,14S,15R)-2,6,6,11,15-pentamethyl-14-[(2S)-6-methylhept-5-en-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-en-5-ol
Traditional IUPAC Name
lanosterol
SMILES
C[C@@H](CCC=C(C)C)[C@@H]1CC[C@]2(C)C3=C(CC[C@]12C)[C@]1(C)CC[C@@H](O)C(C)(C)[C@H]1CC3
Độ tan chảy
140.5 °C
Độ hòa tan
3.76e-04 g/l
logP
7.71
logS
-6.1
pKa (strongest acidic)
19.55
pKa (Strongest Basic)
-0.81
PSA
20.23 Å2
Refractivity
134.54 m3·mol-1
Polarizability
55.12 Å3
Rotatable Bond Count
4
H Bond Acceptor Count
1
H Bond Donor Count
1
Physiological Charge
0
Number of Rings
4
Bioavailability
1
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