Glycoside
GD135066
Name:
acidiscalideFormula:
C41H66O13Smiles:
COC1CC(C)OC(OC2C(C)C=CC(=O)C(C)C=C(C)C(=O)C(C)C(O)CC(=O)OC(C(C)C(C)O)C(C)C(O)CC=CC(=O)C(C)(O)CC2C)C1OAglycone:
CC1=CC(C)C(=O)C=CC(C)C(O)C(C)CC(C)(O)C(=O)C=CCC(O)C(C)C(C(C)C(C)O)OC(=O)CC(O)C(C)C1=OSugarmoiety:
COC1CC(C)OC(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.76 |
| AlogP: | 3.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 766.97 | Num_heavy_atoms: | 54 |
| TPSA: | 206.35 | NumAromaticRings: | 0 |
Unique Aglycone
AD54627
Formula: C34H54O10
Smiles:
CC1=CC(C)C(=O)C=CC(C)C(O)C(C)CC(C)(O)C(=O)C=CCC(O)C(C)C(C(C)C(C)O)OC(=O)CC(O)C(C)C1=O| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | 2.88 | Num_rotatable_bonds: | 2 |
| MolWt: | 622.8 | Num_heavy_atoms: | 44 |
| TPSA: | 178.66 | NumAromaticRings: | 0 |
