Glycoside
GD074865
Name:
NoneFormula:
C17H21O6N5Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cnc(-c3ncccn3)nc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1cnc(-c2ncccn2)nc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.49 | Num_rotatable_bonds: | 6 |
| MolWt: | 391.38 | Num_heavy_atoms: | 28 |
| TPSA: | 159.81 | NumAromaticRings: | 2 |
Unique Aglycone
AD34626
Formula: C11H11O2N5
Smiles:
O=C(NCCO)c1cnc(-c2ncccn2)nc1| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.18 |
| AlogP: | -0.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 245.24 | Num_heavy_atoms: | 18 |
| TPSA: | 100.89 | NumAromaticRings: | 2 |
