Glycoside
GD031582
Name:
NoneFormula:
C30H47O10N5Smiles:
CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)C(N)=OAglycone:
CC(C)CC(NC(=O)C1CCCN1C(=O)C(CCCCN)NC(=O)c1ccc(O)cc1)C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.67 |
| AlogP: | -1.9 | Num_rotatable_bonds: | 15 |
| MolWt: | 637.73 | Num_heavy_atoms: | 45 |
| TPSA: | 247.0 | NumAromaticRings: | 1 |
Unique Aglycone
AD20335
Formula: C24H37O5N5
Smiles:
CC(C)CC(NC(=O)C1CCCN1C(=O)C(CCCCN)NC(=O)c1ccc(O)cc1)C(N)=O| HBA: | 10 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 12 |
| MolWt: | 475.59 | Num_heavy_atoms: | 34 |
| TPSA: | 167.85 | NumAromaticRings: | 1 |
