Glycoside
GD088919
Name:
NoneFormula:
C18H21O7N7Smiles:
COc1cc(/C=N/Nc2nc3c(=O)[nH]c(N)nc3n2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)ccc1OAglycone:
COc1cc(C=NNC2=Nc3c(nc(N)[nH]c3=O)[N]2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.33 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 447.41 | Num_heavy_atoms: | 32 |
| TPSA: | 213.36 | NumAromaticRings: | 3 |
Unique Aglycone
AD38883
Formula: C13H12O3N7
Smiles:
COc1cc(C=NNC2=Nc3c(nc(N)[nH]c3=O)[N]2)ccc1O| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.08 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 314.29 | Num_heavy_atoms: | 23 |
| TPSA: | 152.08 | NumAromaticRings: | 2 |
