Glycoside
GD011543
Name:
NoneFormula:
C26H30O8Smiles:
CC1(C)c2cc(OC[C@H](O)[C@H](O)CO)ccc2C(=O)c2c1oc1cc(OCCCCO)ccc21Aglycone:
CC1(C)c2ccccc2C(=O)c2c1oc1cc(OCCCCO)ccc21Sugarmoiety:
OCC(O)C(O)COOOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 2.55 | Num_rotatable_bonds: | 10 |
| MolWt: | 470.52 | Num_heavy_atoms: | 34 |
| TPSA: | 129.59 | NumAromaticRings: | 3 |
Unique Aglycone
AD08812
Formula: C22H22O4
Smiles:
CC1(C)c2ccccc2C(=O)c2c1oc1cc(OCCCCO)ccc21| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.32 |
| AlogP: | 4.45 | Num_rotatable_bonds: | 5 |
| MolWt: | 350.41 | Num_heavy_atoms: | 26 |
| TPSA: | 59.67 | NumAromaticRings: | 3 |
