Glycoside
GD153116
Name:
24-O-[Alpha-L-Rhamnopyranosyl-(1-2)-Beta-D-Glucopyranosyl]-28-O-[Beta-D-G+Formula:
C54H90O25Smiles:
CC1OC(OC2C(OCC3(C)C(O)CCC4(C)C3CCC3(C)C4CC=C4C5CC(C)(C)C(O)C(O)C5(COC5OC(CO)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C(O)CC43C)OC(CO)C(O)C2O)C(O)C(O)C1OAglycone:
CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CC(O)C2(CO)C(O)C1OSugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 25 | RingCount: | 9 |
| HBD: | 17 | FractionCSP3: | 0.96 |
| AlogP: | -4.65 | Num_rotatable_bonds: | 13 |
| MolWt: | 1139.29 | Num_heavy_atoms: | 79 |
| TPSA: | 417.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD00548
Formula: C30H50O6
Smiles:
CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CC(O)C2(CO)C(O)C1O| HBA: | 6 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | 3.03 | Num_rotatable_bonds: | 2 |
| MolWt: | 506.72 | Num_heavy_atoms: | 36 |
| TPSA: | 121.38 | NumAromaticRings: | 0 |
