Glycoside
GD137911
Name:
methyl 2-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzoateFormula:
C16H21O8NSmiles:
COC(=O)c1ccccc1OC1OC(CO)C(O)C(O)C1N=C(C)OAglycone:
COC(=O)c1ccccc1OSugarmoiety:
CC(O)=NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.36 | Num_rotatable_bonds: | 5 |
| MolWt: | 355.34 | Num_heavy_atoms: | 25 |
| TPSA: | 138.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD05895
Formula: C8H8O3
Smiles:
COC(=O)c1ccccc1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 152.15 | Num_heavy_atoms: | 11 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
