Glycoside
GD066815
Name:
NoneFormula:
C15H17O7N3Smiles:
O[C@@H]1[C@@H](O)[C@H](O)O[C@H](Cn2cc(-c3ccc4c(c3)OCO4)nn2)[C@@H]1OAglycone:
Cn1cc(-c2ccc3c(c2)OCO3)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 3 |
| MolWt: | 351.32 | Num_heavy_atoms: | 25 |
| TPSA: | 139.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD31951
Formula: C10H9O2N3
Smiles:
Cn1cc(-c2ccc3c(c2)OCO3)nn1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 1 |
| MolWt: | 203.2 | Num_heavy_atoms: | 15 |
| TPSA: | 49.17 | NumAromaticRings: | 2 |
