Glycoside
GD143648
Name:
Itoside KFormula:
C26H34O15Smiles:
OCc1cc(OC2OC(CO)C(O)C(O)C2O)c(Cc2cc(O)ccc2OC2OC(CO)C(O)C(O)C2O)cc1OAglycone:
OCc1cc(O)c(Cc2cc(O)ccc2O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 11 | FractionCSP3: | 0.54 |
| AlogP: | -3.46 | Num_rotatable_bonds: | 9 |
| MolWt: | 586.54 | Num_heavy_atoms: | 41 |
| TPSA: | 259.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD57763
Formula: C14H14O5
Smiles:
OCc1cc(O)c(Cc2cc(O)ccc2O)cc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.14 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 262.26 | Num_heavy_atoms: | 19 |
| TPSA: | 101.15 | NumAromaticRings: | 2 |
