Glycoside
GD104761
Name:
Echoside BFormula:
C25H24O9Smiles:
COc1c(-c2ccccc2)cc(O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccccc2)c1OAglycone:
COc1c(-c2ccccc2)cc(O)c(-c2ccccc2)c1OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.24 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 468.46 | Num_heavy_atoms: | 34 |
| TPSA: | 145.91 | NumAromaticRings: | 3 |
Unique Aglycone
AD12107
Formula: C19H16O3
Smiles:
COc1c(-c2ccccc2)cc(O)c(-c2ccccc2)c1O| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.05 |
| AlogP: | 4.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.33 | Num_heavy_atoms: | 22 |
| TPSA: | 49.69 | NumAromaticRings: | 3 |
