Glycoside
GD122374
Name:
Eremophiloside CFormula:
C40H68O14Smiles:
CC(CC(O)C(O)C(C)(C)O)C1C(O)CC2(C)C3CC(O)C4C(C)(C)C(OC5OCC(O)C(O)C5OC5OCC(O)C(O)C5O)CCC45CC35CCC12CAglycone:
CC(CC(O)C(O)C(C)(C)O)C1C(O)CC2(C)C3CC(O)C4C(C)(C)C(O)CCC45CC35CCC12CSugarmoiety:
OC1COC(OC2C(O)OCC(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 7 |
| HBD: | 10 | FractionCSP3: | 1.0 |
| AlogP: | 0.17 | Num_rotatable_bonds: | 9 |
| MolWt: | 772.97 | Num_heavy_atoms: | 54 |
| TPSA: | 239.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD49303
Formula: C30H52O6
Smiles:
CC(CC(O)C(O)C(C)(C)O)C1C(O)CC2(C)C3CC(O)C4C(C)(C)C(O)CCC45CC35CCC12C| HBA: | 6 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | 3.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 508.74 | Num_heavy_atoms: | 36 |
| TPSA: | 121.38 | NumAromaticRings: | 0 |
