Glycoside
GD151294
Name:
schefflerin cFormula:
C36H62O10Smiles:
CC(C)(O)C1C(O)CC2(CO)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5C(OC5OC(CO)C(O)C(O)C5O)CC43C)C12Aglycone:
CC(C)(O)C1C(O)CC2(CO)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5C(O)CC43C)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 5 |
| MolWt: | 654.88 | Num_heavy_atoms: | 46 |
| TPSA: | 180.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD60353
Formula: C30H52O5
Smiles:
CC(C)(O)C1C(O)CC2(CO)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5C(O)CC43C)C12| HBA: | 5 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | 4.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 492.74 | Num_heavy_atoms: | 35 |
| TPSA: | 101.15 | NumAromaticRings: | 0 |
