Glycoside
GD091511
Name:
NoneFormula:
C19H29O6N3SSmiles:
C[C@@H]1O[C@@H](OCCNC(=S)Nc2ccc(N3CCOCC3)cc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
OCCNC(=S)Nc1ccc(N2CCOCC2)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | -0.35 | Num_rotatable_bonds: | 6 |
| MolWt: | 427.52 | Num_heavy_atoms: | 29 |
| TPSA: | 115.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD39942
Formula: C13H19O2N3S
Smiles:
OCCNC(=S)Nc1ccc(N2CCOCC2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 4 |
| MolWt: | 281.38 | Num_heavy_atoms: | 19 |
| TPSA: | 56.76 | NumAromaticRings: | 1 |
