Glycoside
GD153599
Name:
KurigalinFormula:
C27H24O18Smiles:
O=CC(COC(=O)c1cc(O)c(O)c(O)c1)(OC(=O)c1cc(O)c(O)c(O)c1)C(O)C(O)COC(=O)c1cc(O)c(O)c(O)c1Aglycone:
O=Cc1cc(O)c(O)c(O)c1.O=Cc1cc(O)c(O)c(O)c1.O=Cc1cc(O)c(O)c(O)c1Sugarmoiety:
O=CC(COO)(OO)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 18 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 0.19 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 11 |
| MolWt: | 636.47 | Num_heavy_atoms: | 45 |
| TPSA: | 318.5 | NumAromaticRings: | 3 |
Unique Aglycone
AD02035
Formula: C7H6O4
Smiles:
O=Cc1cc(O)c(O)c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 1 |
| MolWt: | 154.12 | Num_heavy_atoms: | 11 |
| TPSA: | 77.76 | NumAromaticRings: | 1 |
