Glycoside
GD119314
Name:
N-(4-ethyl-1-methylpyrrolidin-2-yl)-3-hydroxy-2-[3,4,5-trihydroxy-6-(methylsulfanyl)oxan-2-yl]butanamideFormula:
C17H32O6N2SSmiles:
CCC1CC(N=C(O)C(C(C)O)C2OC(SC)C(O)C(O)C2O)N(C)C1Aglycone:
CCC1CC(N=C(O)CC(C)O)N(C)C1Sugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 6 |
| MolWt: | 392.52 | Num_heavy_atoms: | 26 |
| TPSA: | 125.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD47778
Formula: C11H22O2N2
Smiles:
CCC1CC(N=C(O)CC(C)O)N(C)C1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.91 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 214.31 | Num_heavy_atoms: | 15 |
| TPSA: | 56.06 | NumAromaticRings: | 0 |
