Glycoside
GD002668
Name:
PHYLLAMYRICOSIDE AFormula:
C27H30O11Smiles:
COc1cc2c(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(CO)c(C)c(-c3ccc4c(c3)OCO4)c2cc1OCAglycone:
COc1cc2c(O)c(CO)c(C)c(-c3ccc4c(c3)OCO4)c2cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 7 |
| MolWt: | 530.53 | Num_heavy_atoms: | 38 |
| TPSA: | 156.53 | NumAromaticRings: | 3 |
Unique Aglycone
AD02519
Formula: C21H20O6
Smiles:
COc1cc2c(O)c(CO)c(C)c(-c3ccc4c(c3)OCO4)c2cc1OC| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 3.76 | Num_rotatable_bonds: | 4 |
| MolWt: | 368.39 | Num_heavy_atoms: | 27 |
| TPSA: | 77.38 | NumAromaticRings: | 3 |
