Glycoside
GD065349
Name:
NoneFormula:
C15H24O8N2Smiles:
CN1C[C@]2(COCCN(C(=O)[C@H]3O[C@H](O)[C@H](O)[C@@H](O)[C@H]3O)C2)CC1=OAglycone:
CN1CC2(COCCN(C=O)C2)CC1=OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | -3.51 | Num_rotatable_bonds: | 1 |
| MolWt: | 360.36 | Num_heavy_atoms: | 25 |
| TPSA: | 140.0 | NumAromaticRings: | 0 |
Unique Aglycone
AD31431
Formula: C10H16O3N2
Smiles:
CN1CC2(COCCN(C=O)C2)CC1=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.8 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 1 |
| MolWt: | 212.25 | Num_heavy_atoms: | 15 |
| TPSA: | 49.85 | NumAromaticRings: | 0 |
