Glycoside
GD081693
Name:
NoneFormula:
C17H21O11NSmiles:
COC(=O)c1cc(NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)c(OC)c(OC(C)=O)c1Aglycone:
COC(=O)c1cc(N)c(OC)c(OC(C)=O)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 9 |
| MolWt: | 415.35 | Num_heavy_atoms: | 29 |
| TPSA: | 188.92 | NumAromaticRings: | 1 |
Unique Aglycone
AD36738
Formula: C11H13O5N
Smiles:
COC(=O)c1cc(N)c(OC)c(OC(C)=O)c1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 3 |
| MolWt: | 239.23 | Num_heavy_atoms: | 17 |
| TPSA: | 87.85 | NumAromaticRings: | 1 |
