Glycoside
GD130456
Name:
NoneFormula:
C27H32O16Smiles:
OC1=C[C](OCC2OC(O)C(O)C(O)C2O)C2=CC(OCC3OC(O)C(O)C(O)C3O)=C(c3ccc(O)c(O)c3)[OH+]C2=C1Aglycone:
COC1=C(c2ccc(O)c(O)c2)[OH+]C2=CC(O)=CC(OC)C2=C1Sugarmoiety:
OC1OC(O)C(O)C(O)C1O.OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 12 | FractionCSP3: | 0.44 |
| AlogP: | -2.7 | Num_rotatable_bonds: | 7 |
| MolWt: | 612.54 | Num_heavy_atoms: | 43 |
| TPSA: | 272.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD52870
Formula: C17H17O6
Smiles:
COC1=C(c2ccc(O)c(O)c2)[OH+]C2=CC(O)=CC(OC)C2=C1| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.18 |
| AlogP: | 2.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 317.32 | Num_heavy_atoms: | 23 |
| TPSA: | 91.95 | NumAromaticRings: | 1 |
