Glycoside
GD076428
Name:
NoneFormula:
C16H25O6N3SSmiles:
C=CCCNC(=S)N1CC2(CCN2C(=O)[C@H]2O[C@H](O)[C@H](O)[C@@H](O)[C@H]2O)C1Aglycone:
C=CCCNC(=S)N1CC2(CCN2C=O)C1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.75 |
| AlogP: | -2.48 | Num_rotatable_bonds: | 4 |
| MolWt: | 387.46 | Num_heavy_atoms: | 26 |
| TPSA: | 125.73 | NumAromaticRings: | 0 |
Unique Aglycone
AD35243
Formula: C11H17ON3S
Smiles:
C=CCCNC(=S)N1CC2(CCN2C=O)C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.64 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 4 |
| MolWt: | 239.34 | Num_heavy_atoms: | 16 |
| TPSA: | 35.58 | NumAromaticRings: | 0 |
