Glycoside
GD136769
Name:
N-Acetylmuramic Acid 6-PhosphateFormula:
C11H20O11NPSmiles:
CC(O)=NC1C(O)OC(COP(=O)(O)O)C(O)C1OC(C)C(=O)OAglycone:
CC(O)C(=O)O.COP(=O)(O)OSugarmoiety:
CC(O)=NC1C(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.82 |
| AlogP: | -1.62 | Num_rotatable_bonds: | 7 |
| MolWt: | 373.25 | Num_heavy_atoms: | 24 |
| TPSA: | 195.57 | NumAromaticRings: | 0 |
Unique Aglycone
AD00056
Formula: C3H6O3
Smiles:
CC(O)C(=O)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 1 |
| MolWt: | 90.08 | Num_heavy_atoms: | 6 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
