Glycoside
GD134064
Name:
TectorosideFormula:
C30H36O12Smiles:
C=C1CC(OC(=O)C(O)Cc2ccc(O)cc2)C2C(=C)C(=O)OC2C2C(=C)C(OC3OC(CO)C(O)C(O)C3O)CC12Aglycone:
C=C1CC(OC(=O)C(O)Cc2ccc(O)cc2)C2C(=C)C(=O)OC2C2C(=C)C(O)CC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | -0.36 | Num_rotatable_bonds: | 7 |
| MolWt: | 588.61 | Num_heavy_atoms: | 42 |
| TPSA: | 192.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD54240
Formula: C24H26O7
Smiles:
C=C1CC(OC(=O)C(O)Cc2ccc(O)cc2)C2C(=C)C(=O)OC2C2C(=C)C(O)CC12| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 4 |
| MolWt: | 426.47 | Num_heavy_atoms: | 31 |
| TPSA: | 113.29 | NumAromaticRings: | 1 |
