Glycoside
GD117712
Name:
N-({3,4-dihydroxy-5-[2-(morpholin-4-yl)-2-oxoethyl]oxolan-2-yl}methyl)-4-methoxybenzamideFormula:
C19H26O7N2Smiles:
COc1ccc(C(=O)NCC2OC(CC(=O)N3CCOCC3)C(O)C2O)cc1Aglycone:
CC(=O)N1CCOCC1.CNC(=O)c1ccc(OC)cc1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.58 |
| AlogP: | -0.84 | Num_rotatable_bonds: | 6 |
| MolWt: | 394.42 | Num_heavy_atoms: | 28 |
| TPSA: | 117.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD05627
Formula: C9H11O2N
Smiles:
CNC(=O)c1ccc(OC)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 1.05 | Num_rotatable_bonds: | 2 |
| MolWt: | 165.19 | Num_heavy_atoms: | 12 |
| TPSA: | 38.33 | NumAromaticRings: | 1 |
AD24899
Formula: C6H11O2N
Smiles:
CC(=O)N1CCOCC1| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.83 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 0 |
| MolWt: | 129.16 | Num_heavy_atoms: | 9 |
| TPSA: | 29.54 | NumAromaticRings: | 0 |
