Glycoside
GD034847
Name:
NoneFormula:
C33H26O17Smiles:
O=C(OC1OC[C@H](OC(=O)c2ccc(O)c(O)c2)[C@H](OC(=O)c2ccc(O)c(O)c2)[C@H]1OC(=O)c1ccc(O)c(O)c1)c1ccc(O)c(O)c1Aglycone:
O=C(O)c1ccc(O)c(O)c1.O=C(O)c1ccc(O)c(O)c1.O=C(O)c1ccc(O)c(O)c1.O=C(O)c1ccc(O)c(O)c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.15 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 8 |
| MolWt: | 694.55 | Num_heavy_atoms: | 50 |
| TPSA: | 276.27 | NumAromaticRings: | 4 |
Unique Aglycone
AD13437
Formula: C7H6O4
Smiles:
O=C(O)c1ccc(O)c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 1 |
| MolWt: | 154.12 | Num_heavy_atoms: | 11 |
| TPSA: | 77.76 | NumAromaticRings: | 1 |
