Glycoside
GD124936
Name:
Sucro-NeolambertillinFormula:
C26H30O15Smiles:
Cc1cc2cc(OC3(CO)OC(CO)(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)c3c(O)cccc3c2oc1=OAglycone:
Cc1cc2cc(O)c3c(O)cccc3c2oc1=OSugarmoiety:
OCC1OC(OC2(CO)OC(O)(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.5 |
| AlogP: | -2.72 | Num_rotatable_bonds: | 7 |
| MolWt: | 582.51 | Num_heavy_atoms: | 41 |
| TPSA: | 249.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD50511
Formula: C14H10O4
Smiles:
Cc1cc2cc(O)c3c(O)cccc3c2oc1=O| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 0 |
| MolWt: | 242.23 | Num_heavy_atoms: | 18 |
| TPSA: | 70.67 | NumAromaticRings: | 3 |
