Glycoside
GD030031
Name:
NoneFormula:
C31H31O6N7Smiles:
Nc1nc(NN=Cc2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(NN=Cc2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.23 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 11 |
| MolWt: | 597.63 | Num_heavy_atoms: | 44 |
| TPSA: | 182.39 | NumAromaticRings: | 5 |
Unique Aglycone
AD19466
Formula: C26H22O2N7
Smiles:
Nc1nc(NN=Cc2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)nc2c1N=C[N]2| HBA: | 9 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 4.57 | Num_rotatable_bonds: | 9 |
| MolWt: | 464.51 | Num_heavy_atoms: | 35 |
| TPSA: | 121.11 | NumAromaticRings: | 4 |
