Glycoside
GD016704
Name:
EVOLVOSIDE EFormula:
C35H44O20Smiles:
COc1cc(OC)c2c(=O)c(O)c(-c3ccc(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](C)[C@H](O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H](O)[C@H]4O)cc3)oc2c1Aglycone:
COc1cc(OC)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 6 |
| HBD: | 10 | FractionCSP3: | 0.57 |
| AlogP: | -2.96 | Num_rotatable_bonds: | 11 |
| MolWt: | 784.72 | Num_heavy_atoms: | 55 |
| TPSA: | 306.35 | NumAromaticRings: | 3 |
Unique Aglycone
AD11990
Formula: C17H14O6
Smiles:
COc1cc(OC)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 314.29 | Num_heavy_atoms: | 23 |
| TPSA: | 89.13 | NumAromaticRings: | 3 |
