Glycoside
GD083227
Name:
NoneFormula:
C17H17O7N5Smiles:
O=C(Nc1[nH]c(=O)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)Oc1ccccc1Aglycone:
O=C(Nc1[nH]c(=O)nc2c1N=C[N]2)Oc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 4 |
| MolWt: | 403.35 | Num_heavy_atoms: | 29 |
| TPSA: | 171.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD37164
Formula: C12H8O3N5
Smiles:
O=C(Nc1[nH]c(=O)nc2c1N=C[N]2)Oc1ccccc1| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.29 | Num_rotatable_bonds: | 2 |
| MolWt: | 270.23 | Num_heavy_atoms: | 20 |
| TPSA: | 110.54 | NumAromaticRings: | 2 |
