Glycoside
GD090500
Name:
NoneFormula:
C19H20O6N5ClSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2nc3c(Cl)nc4ccccc4n3n2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1nc2c(Cl)nc3ccccc3n2n1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 437.84 | Num_heavy_atoms: | 30 |
| TPSA: | 151.33 | NumAromaticRings: | 3 |
Unique Aglycone
AD39370
Formula: C13H10O2N5Cl
Smiles:
O=C(NCCO)c1nc2c(Cl)nc3ccccc3n2n1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 291.7 | Num_heavy_atoms: | 20 |
| TPSA: | 92.41 | NumAromaticRings: | 3 |
