Glycoside
GD106381
Name:
NoneFormula:
C23H22O14Smiles:
COc1c(-c2ccc(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2)oc2cc(=O)c(OC)c(O)c-2c1OAglycone:
COc1c(-c2ccc(O)c(O)c2)oc2cc(=O)c(OC)c(O)c-2c1OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.3 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 522.42 | Num_heavy_atoms: | 37 |
| TPSA: | 225.81 | NumAromaticRings: | 1 |
Unique Aglycone
AD44166
Formula: C17H14O8
Smiles:
COc1c(-c2ccc(O)c(O)c2)oc2cc(=O)c(OC)c(O)c-2c1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.12 |
| AlogP: | 2.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 346.29 | Num_heavy_atoms: | 25 |
| TPSA: | 129.59 | NumAromaticRings: | 1 |
