Glycoside
GD104586
Name:
NoneFormula:
C25H22O5N6Smiles:
O=c1[nH]cnc2c1nc(N/N=C/c1c3ccccc3cc3ccccc13)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
O=c1[nH]cnc2c1N=C(NN=Cc1c3ccccc3cc3ccccc13)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.2 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 486.49 | Num_heavy_atoms: | 36 |
| TPSA: | 157.88 | NumAromaticRings: | 5 |
Unique Aglycone
AD43999
Formula: C20H13ON6
Smiles:
O=c1[nH]cnc2c1N=C(NN=Cc1c3ccccc3cc3ccccc13)[N]2| HBA: | 7 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.94 | Num_rotatable_bonds: | 2 |
| MolWt: | 353.37 | Num_heavy_atoms: | 27 |
| TPSA: | 96.6 | NumAromaticRings: | 4 |
