Glycoside
GD099004
Name:
NoneFormula:
C23H33O6N4Smiles:
Cc1cc(NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)n(CC2CC[NH+](Cc3ccccc3)CC2)n1Aglycone:
Cc1cc(N)n(CC2CC[NH+](Cc3ccccc3)CC2)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.52 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 10 |
| MolWt: | 461.54 | Num_heavy_atoms: | 33 |
| TPSA: | 149.35 | NumAromaticRings: | 2 |
Unique Aglycone
AD42141
Formula: C17H25N4
Smiles:
Cc1cc(N)n(CC2CC[NH+](Cc3ccccc3)CC2)n1| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 285.42 | Num_heavy_atoms: | 21 |
| TPSA: | 48.28 | NumAromaticRings: | 2 |
