Glycoside
GD011686
Name:
NoneFormula:
C32H48O9N6Smiles:
CCn1c2ccccc2c2cc(NC(=O)[C@H](CCCCN)NC(=O)CNC[C@H](NC(=O)C(O)C(O)C(O)C(O)CO)C(C)O)ccc21Aglycone:
CCn1c2ccccc2c2cc(NC(=O)C(CCCCN)NC(=O)CNCC(N)C(C)O)ccc21Sugarmoiety:
O=C(O)C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 12 | FractionCSP3: | 0.53 |
| AlogP: | -1.74 | Num_rotatable_bonds: | 19 |
| MolWt: | 660.77 | Num_heavy_atoms: | 47 |
| TPSA: | 251.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD08899
Formula: C26H38O3N6
Smiles:
CCn1c2ccccc2c2cc(NC(=O)C(CCCCN)NC(=O)CNCC(N)C(C)O)ccc21| HBA: | 9 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.46 |
| AlogP: | 1.66 | Num_rotatable_bonds: | 13 |
| MolWt: | 482.63 | Num_heavy_atoms: | 35 |
| TPSA: | 147.43 | NumAromaticRings: | 3 |
