Glycoside
GD027853
Name:
NoneFormula:
C30H38O17Smiles:
COc1cccc(C(=O)OC[C@@H]2O[C@H](O[C@@H]3O[C@H](COC(=O)c4cccc(OC)c4OC)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)c1OCAglycone:
COC(=O)c1cccc(OC)c1OC.COC(=O)c1cccc(OC)c1OCSugarmoiety:
OC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | -1.63 | Num_rotatable_bonds: | 12 |
| MolWt: | 670.62 | Num_heavy_atoms: | 47 |
| TPSA: | 238.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD18258
Formula: C10H12O4
Smiles:
COC(=O)c1cccc(OC)c1OC| HBA: | 4 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.3 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 3 |
| MolWt: | 196.2 | Num_heavy_atoms: | 14 |
| TPSA: | 44.76 | NumAromaticRings: | 1 |
