Glycoside
GD147067
Name:
NoneFormula:
C40H52O18Smiles:
CCc1ccc(-c2oc3c(CC=C(C)C)c(OC4OC(CO)C(O)C(O)C4O)cc(O)c3c(=O)c2OC2OC(C)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)cc1Aglycone:
CCc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1Sugarmoiety:
CC1OC(OC2C(O)OC(C)C(O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 6 |
| HBD: | 10 | FractionCSP3: | 0.57 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 11 |
| MolWt: | 820.84 | Num_heavy_atoms: | 58 |
| TPSA: | 287.89 | NumAromaticRings: | 3 |
Unique Aglycone
AD58912
Formula: C22H22O5
Smiles:
CCc1ccc(-c2oc3c(CC=C(C)C)c(O)cc(O)c3c(=O)c2O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.23 |
| AlogP: | 4.65 | Num_rotatable_bonds: | 4 |
| MolWt: | 366.41 | Num_heavy_atoms: | 27 |
| TPSA: | 90.9 | NumAromaticRings: | 3 |
