Glycoside
GD119212
Name:
Xanthorin 1-O-Methyl Ether 8-O-Beta-D-GeFormula:
C29H34O17Smiles:
COc1cc(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)c2c(c1O)C(=O)c1cc(CO)cc(OC)c1C2=OAglycone:
COc1cc(O)c2c(c1O)C(=O)c1cc(CO)cc(OC)c1C2=OSugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.52 |
| AlogP: | -3.32 | Num_rotatable_bonds: | 9 |
| MolWt: | 654.57 | Num_heavy_atoms: | 46 |
| TPSA: | 271.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD47723
Formula: C17H14O7
Smiles:
COc1cc(O)c2c(c1O)C(=O)c1cc(CO)cc(OC)c1C2=O| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.29 | Num_heavy_atoms: | 24 |
| TPSA: | 113.29 | NumAromaticRings: | 2 |
