Glycoside
GD020834
Name:
NoneFormula:
C21H42O9N4Smiles:
CN[C@@H]1[C@H](O)[C@H](O[C@H]2[C@H](N)C[C@@H](N)[C@@H](O[C@@H]3C[C@H](C(C)O)[C@H](O)[C@H](O)[C@H]3N)[C@H]2O)OC[C@]1(C)OAglycone:
CC(O)C1CC(OC2C(N)CC(N)C(O)C2O)C(N)C(O)C1OSugarmoiety:
CNC1C(O)C(O)OCC1(C)OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 13 | FractionCSP3: | 1.0 |
| AlogP: | -4.95 | Num_rotatable_bonds: | 6 |
| MolWt: | 494.59 | Num_heavy_atoms: | 34 |
| TPSA: | 239.16 | NumAromaticRings: | 0 |
Unique Aglycone
AD14324
Formula: C14H29O6N3
Smiles:
CC(O)C1CC(OC2C(N)CC(N)C(O)C2O)C(N)C(O)C1O| HBA: | 9 | RingCount: | 2 |
| HBD: | 11 | FractionCSP3: | 1.0 |
| AlogP: | -4.03 | Num_rotatable_bonds: | 3 |
| MolWt: | 335.4 | Num_heavy_atoms: | 23 |
| TPSA: | 188.44 | NumAromaticRings: | 0 |
