Tìm theo
Sucrose
Thuốc Gốc
Small Molecule
CAS: 57-50-1
CTHH: C12H22O11
PTK: 342.2965
A nonreducing disaccharide composed of glucose and fructose linked via their anomeric carbons. It is obtained commercially from sugarcane, sugar beet (beta vulgaris), and other plants and used extensively as a food and a sweetener. [PubChem]
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C12H22O11
Phân tử khối
342.2965
Monoisotopic mass
342.116211546
InChI
InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11+,12+/m0/s1
InChI Key
InChIKey=CZMRCDWAGMRECN-MTNNYNCSSA-N
IUPAC Name
(2R,3S,4R,5R,6S)-2-{[(2R,3R,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Traditional IUPAC Name
sucrose
SMILES
OC[C@@H]1O[C@](CO)(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H]1O
Độ tan chảy
185.5 °C
Độ hòa tan
2.1E+006 mg/L (at 25 °C)
logP
-3.70
logS
0.38
pKa (strongest acidic)
11.84
pKa (Strongest Basic)
-3
PSA
189.53 Å2
Refractivity
68.77 m3·mol-1
Polarizability
31.32 Å3
Rotatable Bond Count
5
H Bond Acceptor Count
11
H Bond Donor Count
8
Physiological Charge
0
Number of Rings
2
Bioavailability
0
caco2 Permeability
-5.77
pKa
12.6
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB02772
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46936484
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46506134
KEGG Compound
http://www.genome.jp/dbget-bin/www_bget?cpd:C00089
KEGG Drug
http://www.genome.jp/dbget-bin/www_bget?drug:D00025
PharmGKB
http://www.pharmgkb.org/drug/PA451525
Wikipedia
http://en.wikipedia.org/wiki/Sucrose
RxList
http://www.rxlist.com/cgi/generic/venofer.htm
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