Glycoside
GD025954
Name:
NoneFormula:
C33H52O13Smiles:
CC(=O)C1=C[C@H](O)[C@@H]2[C@@H]3CC[C@@H]4C[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]4(C)[C@H]3CC[C@]12CAglycone:
CC(=O)C1=CC(O)C2C3CCC4CC(O)CCC4(C)C3CCC12CSugarmoiety:
OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.91 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 7 |
| MolWt: | 656.77 | Num_heavy_atoms: | 46 |
| TPSA: | 215.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD17149
Formula: C21H32O3
Smiles:
CC(=O)C1=CC(O)C2C3CCC4CC(O)CCC4(C)C3CCC12C| HBA: | 3 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | 3.49 | Num_rotatable_bonds: | 1 |
| MolWt: | 332.48 | Num_heavy_atoms: | 24 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
