Glycoside
GD004593
Name:
NoneFormula:
C24H47O10N7Smiles:
NC[C@@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](N)[C@H]3O)[C@@H](N)C[C@H]2N)[C@H](N)[C@H](O)[C@H]1NC(=O)C1CCNCC1Aglycone:
NCC1OC(OC2C(N)CC(N)C(O)C2O)C(N)C(O)C1NC(=O)C1CCNCC1Sugarmoiety:
NC1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 4 |
| HBD: | 17 | FractionCSP3: | 0.96 |
| AlogP: | -7.2 | Num_rotatable_bonds: | 8 |
| MolWt: | 593.68 | Num_heavy_atoms: | 41 |
| TPSA: | 309.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD03989
Formula: C18H36O6N6
Smiles:
NCC1OC(OC2C(N)CC(N)C(O)C2O)C(N)C(O)C1NC(=O)C1CCNCC1| HBA: | 12 | RingCount: | 3 |
| HBD: | 13 | FractionCSP3: | 0.94 |
| AlogP: | -4.99 | Num_rotatable_bonds: | 5 |
| MolWt: | 432.52 | Num_heavy_atoms: | 30 |
| TPSA: | 224.36 | NumAromaticRings: | 0 |
