Glycoside
GD127380
Name:
NoneFormula:
C21H20O11Smiles:
O=C(O)C1OC(Oc2ccc([C]3C=Cc4c(O)cc(O)cc4[OH+]3)cc2O)C(O)C(O)C1OAglycone:
Oc1cc(O)c2c(c1)[OH+]C(c1ccc(O)c(O)c1)C=C2Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.24 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 448.38 | Num_heavy_atoms: | 32 |
| TPSA: | 189.94 | NumAromaticRings: | 2 |
Unique Aglycone
AD46157
Formula: C15H13O5
Smiles:
Oc1cc(O)c2c(c1)[OH+]C(c1ccc(O)c(O)c1)C=C2| HBA: | 5 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.07 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 1 |
| MolWt: | 273.26 | Num_heavy_atoms: | 20 |
| TPSA: | 93.72 | NumAromaticRings: | 2 |
