Glycoside
GD029271
Name:
NoneFormula:
C25H36O8Smiles:
C=C1CC[C@@H]2[C@@](C)(C(=O)O[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)CCC[C@@]2(C)[C@H]1CCC1=CCOC1=OAglycone:
C=C1CCC2C(C)(C(=O)O)CCCC2(C)C1CCC1=CCOC1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.76 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 464.56 | Num_heavy_atoms: | 33 |
| TPSA: | 122.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD19058
Formula: C20H28O4
Smiles:
C=C1CCC2C(C)(C(=O)O)CCCC2(C)C1CCC1=CCOC1=O| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.7 |
| AlogP: | 4.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 332.44 | Num_heavy_atoms: | 24 |
| TPSA: | 63.6 | NumAromaticRings: | 0 |
