Glycoside
GD008133
Name:
NoneFormula:
C25H24O3N4Smiles:
C[C@@H]1O[C@H](n2cc(-c3ccccc3)c3c(N4CCc5ccccc54)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=C(c2ccccc2)c2c(ncnc2N2CCc3ccccc32)[N]1Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 6 |
| HBD: | 2 | FractionCSP3: | 0.28 |
| AlogP: | 3.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 428.49 | Num_heavy_atoms: | 32 |
| TPSA: | 83.64 | NumAromaticRings: | 4 |
Unique Aglycone
AD06535
Formula: C20H15N4
Smiles:
C1=C(c2ccccc2)c2c(ncnc2N2CCc3ccccc32)[N]1| HBA: | 4 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.1 |
| AlogP: | 3.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 311.37 | Num_heavy_atoms: | 24 |
| TPSA: | 43.12 | NumAromaticRings: | 3 |
