Glycoside
GD060197
Name:
NoneFormula:
C16H23O5N3Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2cc(C3CC3)nc(C3CC3)n2)[C@@H](O)[C@@H]1OAglycone:
Nc1cc(C2CC2)nc(C2CC2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.75 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 5 |
| MolWt: | 337.38 | Num_heavy_atoms: | 24 |
| TPSA: | 127.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD29750
Formula: C10H13N3
Smiles:
Nc1cc(C2CC2)nc(C2CC2)n1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 175.23 | Num_heavy_atoms: | 13 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
