Glucosaminyl-(Alpha-6)-D-Myo-Inositol
Thuốc Gốc
Small Molecule
CTHH: C12H23NO10
PTK: 341.3117
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C12H23NO10
Phân tử khối
341.3117
Monoisotopic mass
341.132195961
InChI
InChI=1S/C12H23NO10/c13-3-5(16)4(15)2(1-14)22-12(3)23-11-9(20)7(18)6(17)8(19)10(11)21/h2-12,14-21H,1,13H2/t2-,3-,4-,5-,6-,7-,8+,9+,10-,11-,12+/m0/s1
InChI Key
InChIKey=HEPUIGACZYVUCD-JPGQGNGZSA-N
IUPAC Name
(1R,2S,3s,4R,5S,6r)-6-{[(2R,3S,4S,5R,6S)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohexane-1,2,3,4,5-pentol
Traditional IUPAC Name
(1R,2S,3s,4R,5S,6r)-6-{[(2R,3S,4S,5R,6S)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohexane-1,2,3,4,5-pentol
SMILES
N[C@H]1[C@H](O)[C@@H](O)[C@H](CO)O[C@@H]1O[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O
Độ hòa tan
3.87e+02 g/l
logP
-5.7
logS
0.05
pKa (strongest acidic)
12.25
pKa (Strongest Basic)
8.13
PSA
206.32 Å2
Refractivity
69.85 m3·mol-1
Polarizability
31.67 Å3
Rotatable Bond Count
3
H Bond Acceptor Count
11
H Bond Donor Count
9
Physiological Charge
1
Number of Rings
2
Bioavailability
0
Tài Liệu Tham Khảo Thêm
drugbank
PubChem Compound
PubChem Substance
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