The Biofilms Structural Database
|
|
The Biofilms Structural Database |
N-Glycine-[3-Hydroxy-2-Methyl-5-PHosphonooxymethyl-Pyrindin-4-Yl-Methane] |
|
|---|---|
2WK9_A |
|
Code
PLG | |
|
Name |
N-GLYCINE-[3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-PYRIDIN-4-YL-METHANE] |
|
Molecular Weight |
306.21 |
|
Isomeric SMILES |
Cc1ncc(COP(O)(O)=O)c(CNCC(O)=O)c1O |
|
Formula |
C10H15N2O7P |
|
Identifiers |
2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]ethanoic acid |
|
Formal Charge |
0 |
|
InChI |
InChI=1S/C10H15N2O7P/c1-6-10(15)8(3-11-4-9(13)14)7(2-12-6)5-19-20(16,17)18/h2,11,15H,3-5H2,1H3,(H,13,14)(H2,16,17,18) |
|
Atom Count |
35 |
|
InChIKey |
FEVQWBMNLWUBTF-UHFFFAOYSA-N |
|
PDB codes |
2WK9 |
|
Type |
NON-POLYMER |
|
Chiral Atom Count |
0 |
|
Chiral Atoms |
n/a |
|
Bond Count |
35 |
|
Aromatic Bond Count |
6 |
|
Leaving Atoms |
n/a |