Glycoside
GD091625
Name:
NoneFormula:
C20H27O8N3Smiles:
CCOC(=O)[C@H](C)n1cc(Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)cn1Aglycone:
CCOC(=O)C(C)n1cc(Nc2ccc(O)cc2)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 8 |
| MolWt: | 437.45 | Num_heavy_atoms: | 31 |
| TPSA: | 155.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD39966
Formula: C14H17O3N3
Smiles:
CCOC(=O)C(C)n1cc(Nc2ccc(O)cc2)cn1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 5 |
| MolWt: | 275.31 | Num_heavy_atoms: | 20 |
| TPSA: | 76.38 | NumAromaticRings: | 2 |
