Glycoside
GD124656
Name:
BarbatoflavanFormula:
C24H28O13Smiles:
COc1cc(O)c(OC2OC(CO)C(O)C(O)C2O)c2c1CC(OC(C)=O)C(c1ccc(O)c(O)c1)O2Aglycone:
COc1cc(O)c(O)c2c1CC(OC(C)=O)C(c1ccc(O)c(O)c1)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.46 |
| AlogP: | -0.4 | Num_rotatable_bonds: | 6 |
| MolWt: | 524.48 | Num_heavy_atoms: | 37 |
| TPSA: | 204.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD50371
Formula: C18H18O8
Smiles:
COc1cc(O)c(O)c2c1CC(OC(C)=O)C(c1ccc(O)c(O)c1)O2| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.28 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 362.33 | Num_heavy_atoms: | 26 |
| TPSA: | 125.68 | NumAromaticRings: | 2 |
