Glycoside
GD005485
Name:
NoneFormula:
C30H40O16N4Smiles:
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCCNC(=O)C(O)C(O)C(O)C(O)CO)ccc(NCCNC(=O)C(O)C(O)C(O)C(O)CO)c21Aglycone:
NCCNc1ccc(NCCN)c2c1C(=O)c1c(O)ccc(O)c1C2=OSugarmoiety:
O=C(O)C(O)C(O)C(O)C(O)CO.O=C(O)C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 20 | RingCount: | 3 |
| HBD: | 16 | FractionCSP3: | 0.47 |
| AlogP: | -6.2 | Num_rotatable_bonds: | 18 |
| MolWt: | 712.66 | Num_heavy_atoms: | 50 |
| TPSA: | 359.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD04661
Formula: C18H20O4N4
Smiles:
NCCNc1ccc(NCCN)c2c1C(=O)c1c(O)ccc(O)c1C2=O| HBA: | 8 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.22 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 6 |
| MolWt: | 356.38 | Num_heavy_atoms: | 26 |
| TPSA: | 150.7 | NumAromaticRings: | 2 |
