Glycoside
GD146994
Name:
schefflerin fFormula:
C33H54O9Smiles:
CC1(C)C(O)CCC2(C)C1C(OC1OC(CO)C(O)C(O)C1O)CC1(C)C2CCC2C3C4OCC3(CCC21C)CC4OAglycone:
CC1(C)C(O)CCC2(C)C1C(O)CC1(C)C2CCC2C3C4OCC3(CCC21C)CC4OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 3 |
| MolWt: | 594.79 | Num_heavy_atoms: | 42 |
| TPSA: | 149.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD58888
Formula: C27H44O4
Smiles:
CC1(C)C(O)CCC2(C)C1C(O)CC1(C)C2CCC2C3C4OCC3(CCC21C)CC4O| HBA: | 4 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 4.15 | Num_rotatable_bonds: | 0 |
| MolWt: | 432.65 | Num_heavy_atoms: | 31 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
