Glycoside
GD004980
Name:
NoneFormula:
C22H44O11N6Smiles:
C[C@@H]1O[C@H](O[C@H]2[C@H](O[C@@H]3O[C@H](CN)[C@H](O)[C@H](O)[C@H]3N)[C@@H](N)C[C@@H](NC(=O)[C@H](O)CCN)[C@H]2O)[C@H](O)[C@H](O)[C@H]1NAglycone:
NCCC(O)C(=O)NC1CC(N)C(O)C(O)C1OSugarmoiety:
CC1OC(O)C(O)C(O)C1N.NCC1OC(O)C(N)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 17 | FractionCSP3: | 0.95 |
| AlogP: | -7.43 | Num_rotatable_bonds: | 9 |
| MolWt: | 568.63 | Num_heavy_atoms: | 39 |
| TPSA: | 317.5 | NumAromaticRings: | 0 |
Unique Aglycone
AD02366
Formula: C10H21O5N3
Smiles:
NCCC(O)C(=O)NC1CC(N)C(O)C(O)C1O| HBA: | 8 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.9 |
| AlogP: | -4.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 263.29 | Num_heavy_atoms: | 18 |
| TPSA: | 162.06 | NumAromaticRings: | 0 |
