Glycoside
GD144639
Name:
Phosphoribosyl-AmpFormula:
C15H23O14N5P2Smiles:
N=c1c2ncn(C3OC(COP(=O)(O)O)C(O)C3O)c2ncn1C1OC(COP(=O)(O)O)C(O)C1OAglycone:
COP(=O)(O)O.COP(=O)(O)O.N=C1[N]C=NC2=C1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1O.OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.67 |
| AlogP: | -3.83 | Num_rotatable_bonds: | 8 |
| MolWt: | 559.32 | Num_heavy_atoms: | 36 |
| TPSA: | 292.39 | NumAromaticRings: | 2 |
Unique Aglycone
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 |
AD24591
Formula: C5H3N5
Smiles:
N=C1[N]C=NC2=C1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 0 |
| MolWt: | 133.11 | Num_heavy_atoms: | 10 |
| TPSA: | 76.77 | NumAromaticRings: | 0 |
