Glycoside
GD039213
Name:
guanylyl-2',5'-phosphoguanosineFormula:
C20H25O12N10PSmiles:
Nc1nc2c(ncn2[C@H]2O[C@H](CO[P@](=O)(O)O[C@@H]3[C@@H](O)[C@@H](CO)O[C@H]3n3cnc4c(=O)[nH]c(N)nc43)[C@H](O)[C@@H]2O)c(=O)[nH]1Aglycone:
COP(=O)(O)O.Nc1nc2c(c(=O)[nH]1)N=C[N]2.Nc1nc2c(c(=O)[nH]1)N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1O.OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 22 | RingCount: | 6 |
| HBD: | 11 | FractionCSP3: | 0.5 |
| AlogP: | -4.21 | Num_rotatable_bonds: | 8 |
| MolWt: | 628.45 | Num_heavy_atoms: | 43 |
| TPSA: | 334.32 | NumAromaticRings: | 4 |
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 |
AD00207
Formula: C5H4ON5
Smiles:
Nc1nc2c(c(=O)[nH]1)N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.12 | Num_heavy_atoms: | 11 |
| TPSA: | 98.23 | NumAromaticRings: | 1 |
