Glycoside
GD120626
Name:
Edgeworoside CFormula:
C24H20O10Smiles:
CC1OC(Oc2ccc3ccc(=O)oc3c2-c2c(O)ccc3ccc(=O)oc23)C(O)C(O)C1OAglycone:
O=c1ccc2ccc(O)c(-c3c(O)ccc4ccc(=O)oc34)c2o1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 468.41 | Num_heavy_atoms: | 34 |
| TPSA: | 159.8 | NumAromaticRings: | 4 |
Unique Aglycone
AD20510
Formula: C18H10O6
Smiles:
O=c1ccc2ccc(O)c(-c3c(O)ccc4ccc(=O)oc34)c2o1| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 322.27 | Num_heavy_atoms: | 24 |
| TPSA: | 100.88 | NumAromaticRings: | 4 |
