Glycoside
GD137057
Name:
NoneFormula:
C25H36O7Smiles:
CC(C)C1=C2C3=CC=C(C(=O)O)CC(OC4OCC(O)C(O)C4O)C3(C)CCC2(C)CC1Aglycone:
CC(C)C1=C2C3=CC=C(C(=O)O)CC(O)C3(C)CCC2(C)CC1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | 2.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 448.56 | Num_heavy_atoms: | 32 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD55390
Formula: C20H28O3
Smiles:
CC(C)C1=C2C3=CC=C(C(=O)O)CC(O)C3(C)CCC2(C)CC1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.65 |
| AlogP: | 4.24 | Num_rotatable_bonds: | 2 |
| MolWt: | 316.44 | Num_heavy_atoms: | 23 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
