Glycoside
GD121397
Name:
Wf11605Formula:
C38H60O11Smiles:
CC(=O)OC1CC2(C)C3=C(CCC2C(C)(C)C1OC1OC(CO)C(O)C(O)C1O)C1(C)CC(=O)C(C)(C(C)C(C)C)C(C(=O)O)C1(C)CC3Aglycone:
CC(=O)OC1CC2(C)C3=C(CCC2C(C)(C)C1O)C1(C)CC(=O)C(C)(C(C)C(C)C)C(C(=O)O)C1(C)CC3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | 4.02 | Num_rotatable_bonds: | 7 |
| MolWt: | 692.89 | Num_heavy_atoms: | 49 |
| TPSA: | 180.05 | NumAromaticRings: | 0 |
Unique Aglycone
AD48862
Formula: C32H50O6
Smiles:
CC(=O)OC1CC2(C)C3=C(CCC2C(C)(C)C1O)C1(C)CC(=O)C(C)(C(C)C(C)C)C(C(=O)O)C1(C)CC3| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.84 |
| AlogP: | 6.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 530.75 | Num_heavy_atoms: | 38 |
| TPSA: | 100.9 | NumAromaticRings: | 0 |
