Glycoside
GD136917
Name:
Sonchuside DFormula:
C30H38O11Smiles:
C=C1C(=O)OC2C=C(C)C(OC3OC(CO)C(O)C(O)C3O)CC=C(C)C(OC(=O)Cc3ccc(OC)cc3)CC12Aglycone:
C=C1C(=O)OC2C=C(C)C(O)CC=C(C)C(OC(=O)Cc3ccc(OC)cc3)CC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 7 |
| MolWt: | 574.62 | Num_heavy_atoms: | 41 |
| TPSA: | 161.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD55334
Formula: C24H28O6
Smiles:
C=C1C(=O)OC2C=C(C)C(O)CC=C(C)C(OC(=O)Cc3ccc(OC)cc3)CC12| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.42 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 4 |
| MolWt: | 412.48 | Num_heavy_atoms: | 30 |
| TPSA: | 82.06 | NumAromaticRings: | 1 |
