Glycoside
GD021494
Name:
NoneFormula:
C33H36O6N6Smiles:
COc1cc(OC)cc(C(CNc2nc(Nc3ccccc3)nc3c2ncn3C2O[C@H](CO)[C@H](O)[C@H]2O)c2ccccc2C)c1Aglycone:
COc1cc(OC)cc(C(CNc2nc(Nc3ccccc3)nc3c2N=C[N]3)c2ccccc2C)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | 3.75 | Num_rotatable_bonds: | 11 |
| MolWt: | 612.69 | Num_heavy_atoms: | 45 |
| TPSA: | 156.04 | NumAromaticRings: | 5 |
Unique Aglycone
AD14694
Formula: C28H27O2N6
Smiles:
COc1cc(OC)cc(C(CNc2nc(Nc3ccccc3)nc3c2N=C[N]3)c2ccccc2C)c1| HBA: | 8 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.18 |
| AlogP: | 5.7 | Num_rotatable_bonds: | 9 |
| MolWt: | 479.56 | Num_heavy_atoms: | 36 |
| TPSA: | 94.76 | NumAromaticRings: | 4 |
