Glycoside
GD073214
Name:
NoneFormula:
C17H22O8N2Smiles:
COc1cc2c(cc1NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)N(C(C)=O)CC2Aglycone:
COc1cc2c(cc1N)N(C(C)=O)CC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 7 |
| MolWt: | 382.37 | Num_heavy_atoms: | 27 |
| TPSA: | 156.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD33986
Formula: C11H14O2N2
Smiles:
COc1cc2c(cc1N)N(C(C)=O)CC2| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 1 |
| MolWt: | 206.24 | Num_heavy_atoms: | 15 |
| TPSA: | 55.56 | NumAromaticRings: | 1 |
