Glycoside
GD144726
Name:
Sophoraflavanone I 7-O-Beta-GlucosideFormula:
C45H48O14Smiles:
C=C(C)C(CC=C(C)C)Cc1c(OC2OC(CO)C(O)C(O)C2O)cc(O)c2c1OC(c1cc3c(cc1O)OC(c1ccc(O)cc1)C3c1cc(O)cc(O)c1)CC2=OAglycone:
C=C(C)C(CC=C(C)C)Cc1c(O)cc(O)c2c1OC(c1cc3c(cc1O)OC(c1ccc(O)cc1)C3c1cc(O)cc(O)c1)CC2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 7 |
| HBD: | 9 | FractionCSP3: | 0.36 |
| AlogP: | 5.46 | Num_rotatable_bonds: | 11 |
| MolWt: | 812.87 | Num_heavy_atoms: | 59 |
| TPSA: | 236.06 | NumAromaticRings: | 4 |
Unique Aglycone
AD58136
Formula: C39H38O9
Smiles:
C=C(C)C(CC=C(C)C)Cc1c(O)cc(O)c2c1OC(c1cc3c(cc1O)OC(c1ccc(O)cc1)C3c1cc(O)cc(O)c1)CC2=O| HBA: | 9 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.26 |
| AlogP: | 7.98 | Num_rotatable_bonds: | 8 |
| MolWt: | 650.72 | Num_heavy_atoms: | 48 |
| TPSA: | 156.91 | NumAromaticRings: | 4 |
