Glycoside
GD004766
Name:
OdoratoneFormula:
C30H48O4Smiles:
CC(C1OC(C)(C)C(O)C1O)C1CC[C@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@@]4(C)C3CC[C@]12CAglycone:
CCC1CCC2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3CCC12CSugarmoiety:
CC1(C)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 4 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.9 |
| AlogP: | 5.7 | Num_rotatable_bonds: | 2 |
| MolWt: | 472.71 | Num_heavy_atoms: | 34 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD04120
Formula: C24H38O
Smiles:
CCC1CCC2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3CCC12C| HBA: | 1 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.88 |
| AlogP: | 6.57 | Num_rotatable_bonds: | 1 |
| MolWt: | 342.57 | Num_heavy_atoms: | 25 |
| TPSA: | 17.07 | NumAromaticRings: | 0 |
