Glycoside
GD132616
Name:
N-{[5-({[(4-fluorophenyl)methyl]carbamoyl}methyl)-3,4-dihydroxyoxolan-2-yl]methyl}cyclopropanecarboxamideFormula:
C18H23O5N2FSmiles:
OC(CC1OC(CN=C(O)C2CC2)C(O)C1O)=NCc1ccc(F)cc1Aglycone:
CC(O)=NCc1ccc(F)cc1.CN=C(O)C1CC1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 7 |
| MolWt: | 366.39 | Num_heavy_atoms: | 26 |
| TPSA: | 114.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD44951
Formula: C5H9ON
Smiles:
CN=C(O)C1CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 0.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 99.13 | Num_heavy_atoms: | 7 |
| TPSA: | 32.59 | NumAromaticRings: | 0 |
AD45426
Formula: C9H10ONF
Smiles:
CC(O)=NCc1ccc(F)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 2 |
| MolWt: | 167.18 | Num_heavy_atoms: | 12 |
| TPSA: | 32.59 | NumAromaticRings: | 1 |
