Glycoside
GD073201
Name:
NoneFormula:
C17H22O6N3ClSmiles:
O=C(NC1CCN(c2ncccc2Cl)CC1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
NC1CCN(c2ncccc2Cl)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 7 |
| MolWt: | 387.82 | Num_heavy_atoms: | 26 |
| TPSA: | 143.22 | NumAromaticRings: | 1 |
Unique Aglycone
AD33984
Formula: C11H14N3Cl
Smiles:
NC1CCN(c2ncccc2Cl)CC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.66 | Num_rotatable_bonds: | 1 |
| MolWt: | 211.7 | Num_heavy_atoms: | 14 |
| TPSA: | 42.15 | NumAromaticRings: | 1 |
