Glycoside
GD007933
Name:
4'-O-Beta-D-Glucosyl-9-O-(6' '-Deoxysaccharosyl)OlivilFormula:
C38H54O22Smiles:
COc1cc([C@@H]2OC[C@](O)(Cc3ccc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@H]2COC[C@@H]2O[C@@](CO)(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)ccc1OAglycone:
COCC1C(c2ccc(O)c(OC)c2)OCC1(O)Cc1ccc(O)c(OC)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(OC2(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 22 | RingCount: | 6 |
| HBD: | 13 | FractionCSP3: | 0.68 |
| AlogP: | -5.11 | Num_rotatable_bonds: | 16 |
| MolWt: | 862.83 | Num_heavy_atoms: | 60 |
| TPSA: | 346.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD06399
Formula: C21H26O7
Smiles:
COCC1C(c2ccc(O)c(OC)c2)OCC1(O)Cc1ccc(O)c(OC)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 2.42 | Num_rotatable_bonds: | 7 |
| MolWt: | 390.43 | Num_heavy_atoms: | 28 |
| TPSA: | 97.61 | NumAromaticRings: | 2 |
