Glycoside
GD093193
Name:
4,5-bis(acetyloxy)-6-[(1,4-dioxo-1,4-dihydronaphthalen-2-yl)oxy]oxan-3-yl acetateFormula:
C21H20O10Smiles:
CC(=O)O[C@H]1CO[C@@H](OC2=CC(=O)c3ccccc3C2=O)[C@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
O=C1C=C(O)C(=O)c2ccccc21Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.38 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 432.38 | Num_heavy_atoms: | 31 |
| TPSA: | 131.5 | NumAromaticRings: | 1 |
Unique Aglycone
AD15812
Formula: C10H6O3
Smiles:
O=C1C=C(O)C(=O)c2ccccc21| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 0 |
| MolWt: | 174.16 | Num_heavy_atoms: | 13 |
| TPSA: | 54.37 | NumAromaticRings: | 1 |
