Glycoside
GD139299
Name:
AurapinFormula:
C23H26O10Smiles:
COc1ccc(C2Oc3cc(OC)cc(O)c3C(=O)C2OC2OC(C)C(O)C(O)C2O)cc1Aglycone:
COc1ccc(C2Oc3cc(OC)cc(O)c3C(=O)C2O)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 0.94 | Num_rotatable_bonds: | 5 |
| MolWt: | 462.45 | Num_heavy_atoms: | 33 |
| TPSA: | 144.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD52719
Formula: C17H16O6
Smiles:
COc1ccc(C2Oc3cc(OC)cc(O)c3C(=O)C2O)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 2.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.31 | Num_heavy_atoms: | 23 |
| TPSA: | 85.22 | NumAromaticRings: | 2 |
