Glycoside
GD141745
Name:
NoneFormula:
C30H35O16Smiles:
CC1=CC2=C3C(=CC([OH2+])=CC3O1)OC(c1cc(O)c(O)c(O)c1)=C2OC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
CC1=CC2=C3C(=CC([OH2+])=CC3O1)OC(c1cc(O)c(O)c(O)c1)=C2OSugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 6 |
| HBD: | 11 | FractionCSP3: | 0.47 |
| AlogP: | -1.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 651.59 | Num_heavy_atoms: | 46 |
| TPSA: | 260.35 | NumAromaticRings: | 1 |
Unique Aglycone
AD57078
Formula: C18H15O7
Smiles:
CC1=CC2=C3C(=CC([OH2+])=CC3O1)OC(c1cc(O)c(O)c(O)c1)=C2O| HBA: | 7 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.11 |
| AlogP: | 2.17 | Num_rotatable_bonds: | 1 |
| MolWt: | 343.31 | Num_heavy_atoms: | 25 |
| TPSA: | 122.28 | NumAromaticRings: | 1 |
