Glycoside
GD156859
Name:
NoneFormula:
C34H44O21Smiles:
OCC1CC(Oc2cc(O)cc3c2C=C(OOC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(c2ccc(O)c(O)c2)O3)C(O)C(O)C1OAglycone:
OCC1CC(Oc2cc(O)cc3c2C=C(OO)C(c2ccc(O)c(O)c2)O3)C(O)C(O)C1OSugarmoiety:
OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 21 | RingCount: | 6 |
| HBD: | 14 | FractionCSP3: | 0.59 |
| AlogP: | -4.31 | Num_rotatable_bonds: | 11 |
| MolWt: | 788.71 | Num_heavy_atoms: | 55 |
| TPSA: | 347.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD62068
Formula: C22H24O11
Smiles:
OCC1CC(Oc2cc(O)cc3c2C=C(OO)C(c2ccc(O)c(O)c2)O3)C(O)C(O)C1O| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.36 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 464.42 | Num_heavy_atoms: | 33 |
| TPSA: | 189.53 | NumAromaticRings: | 2 |
