Glycoside
GD032412
Name:
NoneFormula:
C23H26O13Smiles:
COc1cc2c(O)c3c(O)c(OC)c(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3c(O)c2c(O)c1OCAglycone:
COc1cc2c(O)c3c(O)c(OC)c(O)cc3c(O)c2c(O)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.39 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 510.45 | Num_heavy_atoms: | 36 |
| TPSA: | 207.99 | NumAromaticRings: | 3 |
Unique Aglycone
AD20791
Formula: C17H16O8
Smiles:
COc1cc2c(O)c3c(O)c(OC)c(O)cc3c(O)c2c(O)c1OC| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.18 |
| AlogP: | 2.55 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.31 | Num_heavy_atoms: | 25 |
| TPSA: | 128.84 | NumAromaticRings: | 3 |
