Glycoside
GD124323
Name:
3-O-[Alpha-L-Rhamnopyranosyl-(1-2)-Beta-D-Xylopyranosyl]-6-O-Beta-D-Gluco+Formula:
C56H92O24Smiles:
CC(=O)OC1COC(OC(CCC(C)C2C(OC(C)=O)CC3(C)C4CC(OC5OC(CO)C(O)C(O)C5O)C5C(C)(C)C(OC6OCC(O)C(O)C6OC6OC(C)C(O)C(O)C6O)CCC56CC46CCC23C)C(C)(C)O)C(O)C1OAglycone:
CC(=O)OC1CC2(C)C3CC(O)C4C(C)(C)C(O)CCC45CC35CCC2(C)C1C(C)CCC(O)C(C)(C)OSugarmoiety:
CC(=O)OC1COC(O)C(O)C1O.CC1OC(OC2C(O)OCC(O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 24 | RingCount: | 9 |
| HBD: | 12 | FractionCSP3: | 0.96 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 16 |
| MolWt: | 1149.33 | Num_heavy_atoms: | 80 |
| TPSA: | 369.2 | NumAromaticRings: | 0 |
Unique Aglycone
AD50215
Formula: C32H54O6
Smiles:
CC(=O)OC1CC2(C)C3CC(O)C4C(C)(C)C(O)CCC45CC35CCC2(C)C1C(C)CCC(O)C(C)(C)O| HBA: | 6 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.97 |
| AlogP: | 4.85 | Num_rotatable_bonds: | 6 |
| MolWt: | 534.78 | Num_heavy_atoms: | 38 |
| TPSA: | 107.22 | NumAromaticRings: | 0 |
