Glycoside
GD008151
Name:
NoneFormula:
C20H23O4N5Smiles:
C[C@@H]1O[C@H](n2cc(-c3ccccc3)c3c(NCCC(N)=O)ncnc32)[C@H](O)[C@H]1OAglycone:
NC(=O)CCNc1ncnc2c1C(c1ccccc1)=C[N]2Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 397.44 | Num_heavy_atoms: | 29 |
| TPSA: | 135.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD06548
Formula: C15H14ON5
Smiles:
NC(=O)CCNc1ncnc2c1C(c1ccccc1)=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.13 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 5 |
| MolWt: | 280.31 | Num_heavy_atoms: | 21 |
| TPSA: | 95.0 | NumAromaticRings: | 2 |
