Glycoside
GD033738
Name:
4'-o-beta-d-glucose glucopiericidin aFormula:
C37H57O14NSmiles:
CC=C(C)[C@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](C)C=C(C)C=CCC(C)=CCc1nc(OC)c(OC)c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1CAglycone:
CC=C(C)C(O)C(C)C=C(C)C=CCC(C)=CCc1nc(OC)c(OC)c(O)c1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.65 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 16 |
| MolWt: | 739.86 | Num_heavy_atoms: | 52 |
| TPSA: | 230.11 | NumAromaticRings: | 1 |
Unique Aglycone
AD18886
Formula: C25H37O4N
Smiles:
CC=C(C)C(O)C(C)C=C(C)C=CCC(C)=CCc1nc(OC)c(OC)c(O)c1C| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.48 |
| AlogP: | 5.46 | Num_rotatable_bonds: | 10 |
| MolWt: | 415.57 | Num_heavy_atoms: | 30 |
| TPSA: | 71.81 | NumAromaticRings: | 1 |
