Home Aminos β-D-Glucopyranoside, 4-aminophenyl 2-(acetylamino)-2-deoxy-

β-D-Glucopyranoside, 4-aminophenyl 2-(acetylamino)-2-deoxy-

CAS No.:
14419-59-1
Catalog Number:
AG001J3P
Molecular Formula:
C14H20N2O6
Molecular Weight:
312.3184
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Product Description
Catalog Number:
AG001J3P
Chemical Name:
β-D-Glucopyranoside, 4-aminophenyl 2-(acetylamino)-2-deoxy-
CAS Number:
14419-59-1
Molecular Formula:
C14H20N2O6
Molecular Weight:
312.3184
MDL Number:
MFCD00056073
IUPAC Name:
N-[(2S,3R,4R,5S,6R)-2-(4-aminophenoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
InChI:
InChI=1S/C14H20N2O6/c1-7(18)16-11-13(20)12(19)10(6-17)22-14(11)21-9-4-2-8(15)3-5-9/h2-5,10-14,17,19-20H,6,15H2,1H3,(H,16,18)/t10-,11-,12-,13-,14-/m1/s1
InChI Key:
RWZITXGZJXXMRL-DHGKCCLASA-N
SMILES:
OC[C@H]1O[C@@H](Oc2ccc(cc2)N)[C@@H]([C@H]([C@@H]1O)O)NC(=O)C
Properties
Complexity:
374  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
312.132g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
312.322g/mol
Monoisotopic Mass:
312.132g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1  
Properties