Glycoside
GD084033
Name:
NoneFormula:
C18H20O7N3ClSmiles:
O=C(CCc1nc(-c2cccc(Cl)c2)no1)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
NC(=O)CCc1nc(-c2cccc(Cl)c2)no1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.76 | Num_rotatable_bonds: | 6 |
| MolWt: | 413.81 | Num_heavy_atoms: | 28 |
| TPSA: | 158.17 | NumAromaticRings: | 2 |
Unique Aglycone
AD37501
Formula: C12H10O2N3Cl
Smiles:
NC(=O)CCc1nc(-c2cccc(Cl)c2)no1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.18 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 4 |
| MolWt: | 251.67 | Num_heavy_atoms: | 17 |
| TPSA: | 82.01 | NumAromaticRings: | 2 |
