Glycoside
GD002335
Name:
NoneFormula:
C20H40O10N6Smiles:
CC(=O)N[C@@H]1[C@H](CN)O[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]1OAglycone:
CC(=O)NC1C(CN)OC(OC2C(N)CC(N)C(O)C2O)C(N)C1OSugarmoiety:
NC1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 3 |
| HBD: | 16 | FractionCSP3: | 0.95 |
| AlogP: | -7.18 | Num_rotatable_bonds: | 7 |
| MolWt: | 524.57 | Num_heavy_atoms: | 36 |
| TPSA: | 297.27 | NumAromaticRings: | 0 |
Unique Aglycone
AD02237
Formula: C14H29O6N5
Smiles:
CC(=O)NC1C(CN)OC(OC2C(N)CC(N)C(O)C2O)C(N)C1O| HBA: | 11 | RingCount: | 2 |
| HBD: | 12 | FractionCSP3: | 0.93 |
| AlogP: | -4.97 | Num_rotatable_bonds: | 4 |
| MolWt: | 363.42 | Num_heavy_atoms: | 25 |
| TPSA: | 212.33 | NumAromaticRings: | 0 |
