Glycoside
GD077515
Name:
1-(1-hydroxy-3-methyl-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}naphthalen-2-yl)ethan-1-oneFormula:
C19H22O8Smiles:
CC(=O)c1c(C)cc2cccc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c2c1OAglycone:
CC(=O)c1c(C)cc2cccc(O)c2c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 4 |
| MolWt: | 378.38 | Num_heavy_atoms: | 27 |
| TPSA: | 136.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD02570
Formula: C13H12O3
Smiles:
CC(=O)c1c(C)cc2cccc(O)c2c1O| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 2.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 216.24 | Num_heavy_atoms: | 16 |
| TPSA: | 57.53 | NumAromaticRings: | 2 |
