Glycoside
GD121396
Name:
DalpaninFormula:
C26H30O12Smiles:
CC(C)(O)C1Cc2cc(C3COc4c(c(O)cc(O)c4C4OC(CO)C(O)C(O)C4O)C3=O)c(O)cc2O1Aglycone:
CC(C)(O)C1Cc2cc(C3COc4cc(O)cc(O)c4C3=O)c(O)cc2O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.5 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 4 |
| MolWt: | 534.51 | Num_heavy_atoms: | 38 |
| TPSA: | 206.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD48861
Formula: C20H20O7
Smiles:
CC(C)(O)C1Cc2cc(C3COc4cc(O)cc(O)c4C3=O)c(O)cc2O1| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 2.24 | Num_rotatable_bonds: | 2 |
| MolWt: | 372.37 | Num_heavy_atoms: | 27 |
| TPSA: | 116.45 | NumAromaticRings: | 2 |
