Glycoside
GD087916
Name:
NoneFormula:
C20H26O7N4Smiles:
O=C(C(=O)N1Cc2nccn2C[C@H](COCc2cccnc2)C1)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
c1cncc(COCC2CNCc3nccn3C2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.9 | Num_rotatable_bonds: | 9 |
| MolWt: | 434.45 | Num_heavy_atoms: | 31 |
| TPSA: | 158.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD38545
Formula: C14H18ON4
Smiles:
c1cncc(COCC2CNCc3nccn3C2)c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.43 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 258.32 | Num_heavy_atoms: | 19 |
| TPSA: | 51.97 | NumAromaticRings: | 2 |
