The Biofilms Structural Database
Name
1-O-[P-NITROPHENYL]-BETA-D-GALACTOPYRANOSE
Molecular Weight
301.25
Isomeric SMILES
OC[C@H]1O[C@@H](Oc2ccc(cc2)[N+]([O-])=O)[C@H](O)[C@@H](O)[C@H]1O
Formula
C12H15NO8
Identifiers
(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxane-3,4,5-triol
Formal Charge
0
InChI
InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/m1/s1
Atom Count
36
InChIKey
IFBHRQDFSNCLOZ-YBXAARCKSA-N
PDB codes
3ZYF
Type
D-SACCHARIDE
Chiral Atom Count
5
Chiral Atoms
C1, C2, C3, C4, C5
Bond Count
37
Aromatic Bond Count
6
Leaving Atoms
n/a