Glycoside
GD115867
Name:
NoneFormula:
C33H43O20Smiles:
CC1OC(OCC2OC(OCC3OC(OC4=Cc5c(O)cc([OH2+])cc5OC4c4ccc(O)c(O)c4)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
OC1=Cc2c(O)cc([OH2+])cc2OC1c1ccc(O)c(O)c1Sugarmoiety:
CC1OC(OCC2OC(OCC3OC(O)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 6 |
| HBD: | 14 | FractionCSP3: | 0.58 |
| AlogP: | -3.79 | Num_rotatable_bonds: | 9 |
| MolWt: | 759.69 | Num_heavy_atoms: | 53 |
| TPSA: | 330.27 | NumAromaticRings: | 2 |
Unique Aglycone
AD45250
Formula: C15H13O6
Smiles:
OC1=Cc2c(O)cc([OH2+])cc2OC1c1ccc(O)c(O)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 2.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 289.26 | Num_heavy_atoms: | 21 |
| TPSA: | 113.05 | NumAromaticRings: | 2 |
