Glycoside
GD126135
Name:
6'''-Hydroxylophirone B 4'''-O-GlucosideFormula:
C36H32O14Smiles:
O=C(C=Cc1ccc(O)c(C2C(=O)c3c(O)cc(OC4OC(CO)C(O)C(O)C4O)cc3OC2c2ccc(O)cc2)c1)c1ccc(O)cc1OAglycone:
O=C(C=Cc1ccc(O)c(C2C(=O)c3c(O)cc(O)cc3OC2c2ccc(O)cc2)c1)c1ccc(O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 9 | FractionCSP3: | 0.22 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 8 |
| MolWt: | 688.64 | Num_heavy_atoms: | 50 |
| TPSA: | 243.9 | NumAromaticRings: | 4 |
Unique Aglycone
AD51022
Formula: C30H22O9
Smiles:
O=C(C=Cc1ccc(O)c(C2C(=O)c3c(O)cc(O)cc3OC2c2ccc(O)cc2)c1)c1ccc(O)cc1O| HBA: | 9 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 4.92 | Num_rotatable_bonds: | 5 |
| MolWt: | 526.5 | Num_heavy_atoms: | 39 |
| TPSA: | 164.75 | NumAromaticRings: | 4 |
