Glycoside
GD089029
Name:
NoneFormula:
C21H26O8N2Smiles:
C=CCN1C(=O)C2(CCOCC2)c2cc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)ccc21Aglycone:
C=CCN1C(=O)C2(CCOCC2)c2cc(N)ccc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -1.15 | Num_rotatable_bonds: | 8 |
| MolWt: | 434.45 | Num_heavy_atoms: | 31 |
| TPSA: | 156.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD38908
Formula: C15H18O2N2
Smiles:
C=CCN1C(=O)C2(CCOCC2)c2cc(N)ccc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 258.32 | Num_heavy_atoms: | 19 |
| TPSA: | 55.56 | NumAromaticRings: | 1 |
